data_2llx_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 2llx _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.446 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.44 ' CE2' ' HD3' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.44 ' HD3' ' CE2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.404 HD21 ' CD2' ' A' ' 131' ' ' PHE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.443 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.414 ' O ' ' CG2' ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.443 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.443 ' HE3' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.401 ' CD1' ' CB ' ' A' ' 74' ' ' ALA . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.423 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.414 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.403 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.479 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.402 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.401 ' CB ' ' CD1' ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 75' ' ' ILE . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.444 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HD2' HG11 ' A' ' 88' ' ' VAL . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.423 ' N ' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 96' ' ' TYR . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.448 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.446 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.473 ' HG ' ' CD1' ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD1' ' HG ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.408 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.448 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.436 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.815 0.341 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.418 HG13 ' N ' ' A' ' 22' ' ' LYS . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.401 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.427 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.497 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.422 HD21 ' CZ ' ' A' ' 125' ' ' TYR . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.423 ' CD1' HG23 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.449 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 0.5 OUTLIER -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.423 HG23 ' CD1' ' A' ' 56' ' ' PHE . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.401 ' HD2' HG13 ' A' ' 88' ' ' VAL . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.406 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.453 HG11 ' N ' ' A' ' 96' ' ' TYR . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.516 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.457 ' CD2' HD21 ' A' ' 139' ' ' LEU . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 120' ' ' ILE . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.422 ' CZ ' HD21 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.488 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.401 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.516 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.488 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 80.9 m-70 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.402 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.619 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.619 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.781 0.324 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.463 HD11 ' HB2' ' A' ' 117' ' ' PHE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.412 HG13 ' N ' ' A' ' 22' ' ' LYS . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.412 HD21 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.413 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.457 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.4 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.466 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.466 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.427 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.401 ' CG2' ' CD1' ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.465 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 96' ' ' TYR . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.404 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.477 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.456 ' CD2' HD22 ' A' ' 126' ' ' LEU . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.425 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.492 ' HG ' ' H ' ' A' ' 140' ' ' LEU . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.492 ' H ' ' HG ' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.417 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.413 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.41 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.463 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.414 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.485 ' HD3' ' OG ' ' A' ' 123' ' ' SER . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.417 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.4 ' CG2' ' CD1' ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.441 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.487 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG11 ' N ' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' HG12 ' A' ' 88' ' ' VAL . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.421 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' HG13 ' A' ' 88' ' ' VAL . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.447 ' N ' HG11 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 96' ' ' TYR . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.54 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.485 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.43 ' CD2' ' CD1' ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.479 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.423 ' HB2' HD23 ' A' ' 126' ' ' LEU . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.54 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.456 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 114' ' ' PHE . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.424 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.435 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.418 ' CB ' ' CD2' ' A' ' 126' ' ' LEU . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 123' ' ' SER . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.401 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.425 HD12 HG21 ' A' ' 45' ' ' ILE . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.422 HD23 ' CZ ' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.476 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.424 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mm-40 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.416 ' CD2' HD22 ' A' ' 93' ' ' LEU . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.444 ' N ' HG12 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.432 HG11 ' N ' ' A' ' 96' ' ' TYR . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.441 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.411 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.405 ' HB3' HG13 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.415 ' CE2' HD11 ' A' ' 20' ' ' LEU . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.448 ' CD2' ' CD1' ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.422 ' CZ ' HD23 ' A' ' 52' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.448 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.469 ' O ' ' CD2' ' A' ' 139' ' ' LEU . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.827 0.346 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.406 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.426 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 22' ' ' LYS . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.416 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.428 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.514 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.452 ' HA ' HG23 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HA ' HG12 ' A' ' 88' ' ' VAL . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.417 ' CD1' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.422 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 15.6 t30 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.437 HG22 HD12 ' A' ' 75' ' ' ILE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.427 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.443 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.437 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.443 ' CD1' ' HA ' ' A' ' 81' ' ' ARG . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.421 HG12 ' HA2' ' A' ' 92' ' ' GLY . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.421 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.466 ' O ' ' HD1' ' A' ' 96' ' ' TYR . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.527 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.431 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.443 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.438 HD23 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.41 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.527 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.438 ' CD2' HD23 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.443 ' CD2' ' HB3' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.427 HD12 ' CE2' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.426 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.466 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.423 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.468 HG21 ' N ' ' A' ' 63' ' ' LYS . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.468 ' N ' HG21 ' A' ' 62' ' ' ILE . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.487 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.401 ' HB2' ' HG3' ' A' ' 115' ' ' GLU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 96' ' ' TYR . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.406 ' CG ' ' HB2' ' A' ' 91' ' ' ASN . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.488 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.412 ' O ' ' CD ' ' A' ' 41' ' ' PRO . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.473 ' CD2' HD23 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD22 ' A' ' 139' ' ' LEU . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.632 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.43 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.494 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.436 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.424 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.455 HD13 HG22 ' A' ' 45' ' ' ILE . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.481 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.435 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 4.6 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.438 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.418 ' CE2' HD22 ' A' ' 93' ' ' LEU . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 92' ' ' GLY . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.449 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.418 HD22 ' CE2' ' A' ' 85' ' ' TYR . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 96' ' ' TYR . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.408 ' O ' ' CG1' ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.449 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.403 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.405 ' CE1' ' O ' ' A' ' 10' ' ' ARG . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.424 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.483 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 19.4 m-70 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.721 0.296 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' O ' ' HB ' ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 17' ' ' ILE . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.507 ' N ' ' CD ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 114' ' ' PHE . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.418 HG13 ' N ' ' A' ' 22' ' ' LYS . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.417 ' CD1' ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.428 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.443 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.505 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.491 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.406 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 6.7 t30 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.505 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' CB ' ' CD1' ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 75' ' ' ILE . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.422 ' CD2' HD23 ' A' ' 93' ' ' LEU . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.424 HG11 ' N ' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.401 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' HG13 ' A' ' 88' ' ' VAL . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.424 ' N ' HG11 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 96' ' ' TYR . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.5 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.421 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.414 ' O ' HG12 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.419 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.443 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.456 ' CD2' HD23 ' A' ' 126' ' ' LEU . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.409 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.4 ' O ' HG21 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.481 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.41 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.41 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.411 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.446 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 93' ' ' LEU . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.436 ' HE1' ' CD2' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.431 HD12 ' CE2' ' A' ' 125' ' ' TYR . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.427 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.506 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.491 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.41 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 5.4 t30 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.506 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.419 ' NE2' ' HG ' ' A' ' 52' ' ' LEU . 4.0 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.5 mm-40 -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.469 HG12 ' N ' ' A' ' 96' ' ' TYR . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.492 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.433 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.404 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.404 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.436 ' CD2' ' HE1' ' A' ' 51' ' ' MET . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.459 ' CD2' HD22 ' A' ' 126' ' ' LEU . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.412 HD11 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.459 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.459 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.494 ' HA ' HG21 ' A' ' 94' ' ' VAL . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.432 HG22 ' HB3' ' A' ' 43' ' ' ASP . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.432 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.406 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.448 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.453 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.434 HG13 ' HD2' ' A' ' 89' ' ' PRO . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.434 ' HD2' HG13 ' A' ' 88' ' ' VAL . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.416 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.494 HG21 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG11 ' N ' ' A' ' 96' ' ' TYR . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.47 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.424 ' CE1' ' O ' ' A' ' 10' ' ' ARG . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.41 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.496 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.436 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.472 ' HB2' HD21 ' A' ' 126' ' ' LEU . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.413 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.422 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.418 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.445 HD13 HG23 ' A' ' 35' ' ' ILE . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.404 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.419 ' CD1' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.41 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.419 HG21 ' CD1' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.446 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.446 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA2' ' A' ' 92' ' ' GLY . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HD2' HG11 ' A' ' 88' ' ' VAL . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.401 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 96' ' ' TYR . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 108' ' ' LYS . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.47 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.407 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.404 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.445 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.468 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.429 ' CD2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.47 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.767 0.318 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.427 HD11 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.465 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.409 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.41 ' CD1' ' HB3' ' A' ' 85' ' ' TYR . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.448 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.414 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.45 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.491 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.41 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.451 HG11 ' N ' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CD ' HD21 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.428 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.451 ' N ' HG11 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 96' ' ' TYR . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.462 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.41 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 95' ' ' VAL . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.482 ' CB ' HD22 ' A' ' 139' ' ' LEU . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.448 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.447 ' CD2' HD23 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.445 ' O ' ' CD2' ' A' ' 139' ' ' LEU . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.482 HD22 ' CB ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.419 ' O ' HG23 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.419 HG23 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.43 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.43 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.435 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.41 HG22 HD11 ' A' ' 39' ' ' ILE . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.415 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.405 ' HA ' ' CD1' ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.468 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.468 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.413 HD12 HG23 ' A' ' 75' ' ' ILE . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.429 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.429 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.422 ' CD2' HD21 ' A' ' 93' ' ' LEU . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.412 HG11 ' N ' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 85' ' ' TYR . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.455 HG11 ' N ' ' A' ' 96' ' ' TYR . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.474 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.407 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.452 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.474 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' HD22 ' A' ' 126' ' ' LEU . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.813 0.339 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.422 HG13 ' N ' ' A' ' 22' ' ' LYS . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.455 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.474 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.47 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.402 HD12 ' CD2' ' A' ' 125' ' ' TYR . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.435 HG23 HD11 ' A' ' 39' ' ' ILE . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.479 ' HD3' ' OG ' ' A' ' 123' ' ' SER . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.406 ' CD1' HG23 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.457 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.42 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.42 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.438 HG21 HD12 ' A' ' 75' ' ' ILE . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.456 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA2' ' A' ' 92' ' ' GLY . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.401 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 96' ' ' TYR . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.43 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.479 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.402 ' CD2' HD12 ' A' ' 37' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.481 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.455 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.483 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 19.2 m-70 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.43 ' CD2' ' HB3' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.751 0.31 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' CE2' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.486 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.426 ' HA ' HG23 ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.406 ' CD1' ' CG2' ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.46 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.461 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 75' ' ' ILE . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.412 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.445 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.406 HG13 ' HD2' ' A' ' 89' ' ' PRO . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.406 ' HD2' HG13 ' A' ' 88' ' ' VAL . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.426 HG23 ' HA ' ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.437 HG13 ' N ' ' A' ' 96' ' ' TYR . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.459 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.528 HD21 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.528 ' CD2' HD21 ' A' ' 126' ' ' LEU . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.421 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.44 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.427 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.405 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.409 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.455 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.412 ' CD1' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.457 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.421 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.412 HG21 ' CD1' ' A' ' 56' ' ' PHE . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.433 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.433 ' CD1' ' HA ' ' A' ' 81' ' ' ARG . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.427 HG11 ' HD2' ' A' ' 89' ' ' PRO . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.427 ' HD2' HG11 ' A' ' 88' ' ' VAL . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.422 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.427 ' N ' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.446 HG11 ' N ' ' A' ' 96' ' ' TYR . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.452 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 20' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.521 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.457 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.401 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.409 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.455 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.475 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' HD23 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.521 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.768 0.318 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.431 ' O ' HG21 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.431 HG21 ' O ' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.459 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.459 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.403 ' HA ' ' HG3' ' A' ' 25' ' ' GLU . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.44 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.409 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.409 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 0.6 OUTLIER -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.402 HD12 HG22 ' A' ' 75' ' ' ILE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.412 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.427 ' CD2' HD23 ' A' ' 93' ' ' LEU . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.434 HG12 ' N ' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' A' ' 88' ' ' VAL . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.411 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.434 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.43 HG13 ' N ' ' A' ' 96' ' ' TYR . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.513 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.401 ' CE2' HD21 ' A' ' 20' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.419 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.513 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' HD22 ' A' ' 126' ' ' LEU . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.417 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.418 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.465 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.445 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.449 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 88' ' ' VAL . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.417 HD21 ' CE1' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.478 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.478 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.439 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.439 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . 0.462 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 41' ' ' PRO . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 112' ' ' ILE . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.48 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.458 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.44 ' CE2' ' CD2' ' A' ' 20' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.411 ' HG3' ' CG1' ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.418 ' CE2' HD11 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.411 ' CG1' ' HG3' ' A' ' 116' ' ' PRO . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.417 ' CE1' HD21 ' A' ' 52' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.486 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . 0.408 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.48 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.434 ' CD2' HD22 ' A' ' 126' ' ' LEU . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.831 0.348 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.436 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.463 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.463 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 131' ' ' PHE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.419 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.469 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' PRO . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.435 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.458 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.441 HD13 HG22 ' A' ' 75' ' ' ILE . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.487 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.429 ' CD2' HD22 ' A' ' 93' ' ' LEU . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.42 HG11 ' N ' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 96' ' ' TYR . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.49 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.403 ' HA ' ' HA2' ' A' ' 29' ' ' GLY . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.436 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.407 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . 0.402 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.509 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.419 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PHE . . . . . 0.487 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' HIS . . . . . 0.509 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 94.4 m-70 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.27 153.81 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.142 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -99.78 8.49 44.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.331 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -69.04 149.88 97.68 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.688 0.28 . . . . 0.0 110.926 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.47 -30.39 92.42 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.592 2.195 . . . . 0.0 112.17 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p 170.89 77.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.896 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.18 -87.28 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.479 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.66 -26.84 68.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.446 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.44 ' CE2' ' HD3' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.44 ' HD3' ' CE2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.404 HD21 ' CD2' ' A' ' 131' ' ' PHE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.443 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.414 ' O ' ' CG2' ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.443 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.443 ' HE3' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.401 ' CD1' ' CB ' ' A' ' 74' ' ' ALA . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.423 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.414 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.4 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.403 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.402 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.401 ' CB ' ' CD1' ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 75' ' ' ILE . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.423 HG13 ' N ' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HD2' HG11 ' A' ' 88' ' ' VAL . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.423 ' N ' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 96' ' ' TYR . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.448 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.446 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.473 ' HG ' ' CD1' ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD1' ' HG ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.408 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.448 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.436 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.831 0.348 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.25 168.33 4.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -92.11 -26.86 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.52 146.11 41.07 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.835 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -68.12 -87.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.469 2.112 . . . . 0.0 112.397 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.6 p 174.12 136.27 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.706 0.289 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.64 -40.34 95.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.276 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.76 -31.62 70.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.113 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.418 HG13 ' N ' ' A' ' 22' ' ' LYS . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.401 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.427 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.497 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.422 HD21 ' CZ ' ' A' ' 125' ' ' TYR . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.423 ' CD1' HG23 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.449 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 0.5 OUTLIER -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.423 HG23 ' CD1' ' A' ' 56' ' ' PHE . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.406 HG12 ' N ' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.401 ' HD2' HG13 ' A' ' 88' ' ' VAL . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.406 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.453 HG11 ' N ' ' A' ' 96' ' ' TYR . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.516 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.457 ' CD2' HD21 ' A' ' 139' ' ' LEU . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.404 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 120' ' ' ILE . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.422 ' CZ ' HD21 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.488 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.401 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.516 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.488 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 80.9 m-70 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.402 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.619 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.619 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.799 0.333 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.76 169.13 12.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.103 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -83.78 2.14 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.286 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -75.79 150.27 83.81 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.4 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.417 ' HB2' ' H ' ' A' ' 6' ' ' SER . 83.4 Cg_exo -40.05 -81.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.678 2.252 . . . . 0.0 112.68 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.417 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 59.6 p -127.99 146.6 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 111.012 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.55 -68.99 0.88 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.15 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.83 -29.81 67.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.408 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.428 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.463 HD11 ' HB2' ' A' ' 117' ' ' PHE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.412 HG13 ' N ' ' A' ' 22' ' ' LYS . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.412 HD21 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.413 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.457 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.429 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.4 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.401 ' CD1' ' CG2' ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.466 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.466 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.427 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.401 ' CG2' ' CD1' ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.465 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 96' ' ' TYR . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.404 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.477 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.456 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.456 ' CD2' HD22 ' A' ' 126' ' ' LEU . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.425 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.492 ' HG ' ' H ' ' A' ' 140' ' ' LEU . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.492 ' H ' ' HG ' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.755 0.312 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.43 168.37 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.01 0.433 . . . . 0.0 111.354 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -86.89 8.9 21.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.706 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 2.0 p-10 -53.43 133.16 53.43 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.628 0.251 . . . . 0.0 111.068 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 16.0 Cg_exo -67.81 -10.55 29.18 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.731 2.287 . . . . 0.0 112.888 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.8 p 165.94 80.48 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.791 0.329 . . . . 0.0 110.896 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.69 -87.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.525 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.23 -24.3 67.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.417 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.413 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.41 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.463 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.414 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.485 ' HD3' ' OG ' ' A' ' 123' ' ' SER . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.4 ' CD1' ' CG2' ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.417 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.4 ' CG2' ' CD1' ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.441 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.487 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG11 ' N ' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' HG12 ' A' ' 88' ' ' VAL . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.421 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' HG13 ' A' ' 88' ' ' VAL . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.447 ' N ' HG11 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 96' ' ' TYR . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.54 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.421 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.485 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.43 ' CD2' ' CD1' ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.479 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.423 ' HB2' HD23 ' A' ' 126' ' ' LEU . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.54 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.66 167.49 7.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -89.5 8.47 30.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.335 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.29 150.01 70.14 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.85 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.33 -27.24 47.4 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.645 2.23 . . . . 0.0 112.071 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p 173.85 76.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.56 -86.14 0.06 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.481 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.54 -22.98 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.456 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.456 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 114' ' ' PHE . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.424 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.435 ' HE1' ' CZ ' ' A' ' 131' ' ' PHE . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.418 ' CB ' ' CD2' ' A' ' 126' ' ' LEU . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 123' ' ' SER . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.401 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.425 HD12 HG21 ' A' ' 45' ' ' ILE . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.422 HD23 ' CZ ' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.476 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.424 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mm-40 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.416 ' CD2' HD22 ' A' ' 93' ' ' LEU . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.444 HG12 ' N ' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.444 ' N ' HG12 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.432 HG11 ' N ' ' A' ' 96' ' ' TYR . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.441 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.411 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.405 ' HB3' HG13 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.415 ' CE2' HD11 ' A' ' 20' ' ' LEU . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.448 ' CD2' ' CD1' ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.422 ' CZ ' HD23 ' A' ' 52' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.448 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.469 ' O ' ' CD2' ' A' ' 139' ' ' LEU . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.7 mtt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.867 0.365 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.62 168.27 11.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.178 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.21 -26.91 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.09 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -63.77 149.86 92.08 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.62 -90.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 122.37 2.047 . . . . 0.0 112.19 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -155.02 148.5 25.21 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.839 0.352 . . . . 0.0 111.168 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.12 -53.34 3.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.06 73.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.406 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.426 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 22' ' ' LYS . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.416 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.428 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.514 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.452 ' HA ' HG23 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.406 ' HA ' HG12 ' A' ' 88' ' ' VAL . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.417 ' CD1' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.422 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 15.6 t30 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.437 HG22 HD12 ' A' ' 75' ' ' ILE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.427 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.443 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.437 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.443 ' CD1' ' HA ' ' A' ' 81' ' ' ARG . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.421 HG12 ' HA2' ' A' ' 92' ' ' GLY . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.421 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.466 ' O ' ' HD1' ' A' ' 96' ' ' TYR . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.527 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.431 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.443 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.438 HD23 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.41 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.527 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.438 ' CD2' HD23 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.443 ' CD2' ' HB3' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.773 0.321 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.87 12.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.991 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -84.01 -26.71 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.548 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -94.7 150.22 37.63 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.326 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -53.33 -90.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.386 2.058 . . . . 0.0 111.925 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.405 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 26.9 p -103.49 99.32 9.14 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.718 0.294 . . . . 0.0 111.283 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.39 -83.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.587 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -29.47 70.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.427 HD12 ' CE2' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.426 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.466 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.423 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.468 HG21 ' N ' ' A' ' 63' ' ' LYS . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.468 ' N ' HG21 ' A' ' 62' ' ' ILE . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.419 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.487 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.401 ' HB2' ' HG3' ' A' ' 115' ' ' GLU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 96' ' ' TYR . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.489 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.406 ' CG ' ' HB2' ' A' ' 91' ' ' ASN . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.488 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.412 ' O ' ' CD ' ' A' ' 41' ' ' PRO . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.473 ' CD2' HD23 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD22 ' A' ' 139' ' ' LEU . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.632 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.93 135.96 48.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -86.06 -10.5 54.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -55.54 141.46 63.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.025 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.33 -38.83 93.5 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.463 2.109 . . . . 0.0 112.441 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.8 p -178.6 37.01 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.001 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.85 -81.97 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.232 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.15 -29.24 70.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 18' ' ' LYS . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.43 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.494 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.436 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.424 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.455 HD13 HG22 ' A' ' 45' ' ' ILE . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.481 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.435 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 4.6 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.438 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.418 ' CE2' HD22 ' A' ' 93' ' ' LEU . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 92' ' ' GLY . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.449 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.418 HD22 ' CE2' ' A' ' 85' ' ' TYR . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.436 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 96' ' ' TYR . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.494 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.408 ' O ' ' CG1' ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.449 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.403 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.405 ' CE1' ' O ' ' A' ' 10' ' ' ARG . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.424 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.483 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 19.4 m-70 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptp . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.01 168.83 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.091 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.97 -17.71 39.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.115 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.505 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 10.0 t70 -54.13 144.76 37.78 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.648 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.505 ' HD2' ' CG ' ' A' ' 4' ' ' ASP . 9.5 Cg_endo -49.14 -85.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.801 2.334 . . . . 0.0 112.109 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 78.0 p -96.93 120.06 36.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.863 0.364 . . . . 0.0 111.09 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.2 -82.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.956 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.54 -26.29 20.57 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.13 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.408 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' O ' ' HB ' ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 17' ' ' ILE . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.507 ' N ' ' CD ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 114' ' ' PHE . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.418 HG13 ' N ' ' A' ' 22' ' ' LYS . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.417 ' CD1' ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.428 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.443 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.505 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.491 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.406 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 6.7 t30 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.505 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' CB ' ' CD1' ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 75' ' ' ILE . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.465 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.422 ' CD2' HD23 ' A' ' 93' ' ' LEU . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.424 HG11 ' N ' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.401 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' HG13 ' A' ' 88' ' ' VAL . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.424 ' N ' HG11 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 96' ' ' TYR . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.5 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.421 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.414 ' O ' HG12 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.419 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.443 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.5 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.456 ' CD2' HD23 ' A' ' 126' ' ' LEU . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.409 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.13 168.3 2.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.018 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -109.79 -26.82 9.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 12.9 t70 -60.48 150.35 74.22 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.801 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.8 Cg_endo -80.77 -77.7 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.094 2.53 . . . . 0.0 112.295 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 p -156.21 150.48 25.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 111.225 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.28 -52.91 3.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.918 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 -28.26 69.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.4 ' O ' HG21 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.425 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.481 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.41 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.41 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.411 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.446 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 93' ' ' LEU . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.436 ' HE1' ' CD2' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.431 HD12 ' CE2' ' A' ' 125' ' ' TYR . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.427 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.506 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.491 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.41 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 5.4 t30 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.506 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.419 ' NE2' ' HG ' ' A' ' 52' ' ' LEU . 4.0 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.5 mm-40 -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.405 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.469 HG12 ' N ' ' A' ' 96' ' ' TYR . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.492 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.433 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.404 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.404 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.436 ' CD2' ' HE1' ' A' ' 51' ' ' MET . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.459 ' CD2' HD22 ' A' ' 126' ' ' LEU . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.5 168.38 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -88.49 8.43 28.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -69.64 149.98 96.81 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.719 0.295 . . . . 0.0 110.917 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.5 -6.4 18.88 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.596 2.197 . . . . 0.0 112.762 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.6 p 172.91 75.16 0.0 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.018 0.437 . . . . 0.0 110.941 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.02 -85.6 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.521 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.55 -27.48 68.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.412 HD11 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.459 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.459 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.421 HD21 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.494 ' HA ' HG21 ' A' ' 94' ' ' VAL . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.432 HG22 ' HB3' ' A' ' 43' ' ' ASP . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.417 ' HA ' ' HA2' ' A' ' 92' ' ' GLY . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.432 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.406 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.448 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.453 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.453 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.434 HG13 ' HD2' ' A' ' 89' ' ' PRO . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.434 ' HD2' HG13 ' A' ' 88' ' ' VAL . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 41' ' ' PRO . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.416 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.494 HG21 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG11 ' N ' ' A' ' 96' ' ' TYR . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.47 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.424 ' CE1' ' O ' ' A' ' 10' ' ' ARG . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.41 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.427 ' HG ' ' CD1' ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.496 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.436 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.472 ' HB2' HD21 ' A' ' 126' ' ' LEU . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ptm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.838 0.351 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.93 168.31 12.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.091 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -89.62 8.35 31.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.231 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -83.61 150.13 58.97 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-O 120.714 0.292 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.434 ' HB2' ' H ' ' A' ' 6' ' ' SER . 32.9 Cg_endo -62.45 -151.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.609 2.206 . . . . 0.0 111.695 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.434 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 96.3 p -141.87 139.96 32.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.811 0.339 . . . . 0.0 111.076 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.54 -56.78 2.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.58 -36.5 82.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.93 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.413 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.422 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.418 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.445 HD13 HG23 ' A' ' 35' ' ' ILE . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.404 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.419 ' CD1' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.41 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.419 HG21 ' CD1' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.446 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.446 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA2' ' A' ' 92' ' ' GLY . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HD2' HG11 ' A' ' 88' ' ' VAL . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.401 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.426 HG13 ' N ' ' A' ' 96' ' ' TYR . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 108' ' ' LYS . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.47 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.407 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.404 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.445 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.468 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.429 ' CD2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.47 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 168.92 12.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.91 2.74 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.282 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -86.85 150.14 49.69 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.623 0.249 . . . . 0.0 110.537 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.79 -84.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.508 2.138 . . . . 0.0 112.118 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.461 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 63.0 p -106.35 111.8 24.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.789 0.328 . . . . 0.0 111.034 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.35 -80.25 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.975 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.28 69.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.88 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.461 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.427 HD11 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.465 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' N ' ' CD1' ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.435 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.409 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.41 ' CD1' ' HB3' ' A' ' 85' ' ' TYR . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.448 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.414 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.45 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.491 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.41 ' HB3' ' CD1' ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.451 HG11 ' N ' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CD ' HD21 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.428 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.451 ' N ' HG11 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 96' ' ' TYR . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.462 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.41 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.419 ' HB3' HG11 ' A' ' 95' ' ' VAL . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.482 ' CB ' HD22 ' A' ' 139' ' ' LEU . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.448 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.462 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.447 ' CD2' HD23 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.445 ' O ' ' CD2' ' A' ' 139' ' ' LEU . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.482 HD22 ' CB ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.777 0.322 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.37 168.32 20.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -88.49 -26.98 21.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -62.87 149.8 89.11 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.67 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.59 -78.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.355 2.037 . . . . 0.0 112.116 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -163.84 30.52 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.772 0.32 . . . . 0.0 111.335 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.64 -87.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.891 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.79 -26.07 67.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.419 ' O ' HG23 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.419 HG23 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.43 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.43 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.435 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.41 HG22 HD11 ' A' ' 39' ' ' ILE . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.415 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.405 ' HA ' ' CD1' ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.468 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.468 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.413 HD12 HG23 ' A' ' 75' ' ' ILE . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.417 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.429 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.429 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.422 ' CD2' HD21 ' A' ' 93' ' ' LEU . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.412 HG11 ' N ' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 85' ' ' TYR . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.44 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.455 HG11 ' N ' ' A' ' 96' ' ' TYR . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.474 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.407 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.452 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.474 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' HD22 ' A' ' 126' ' ' LEU . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.407 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.916 0.389 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.76 168.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.137 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -93.89 -26.88 16.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.049 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.0 p-10 -66.82 144.24 98.46 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.832 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -63.14 -69.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.491 2.127 . . . . 0.0 112.205 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -161.98 145.42 12.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.058 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.17 -46.36 8.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.117 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.422 HG13 ' N ' ' A' ' 22' ' ' LYS . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.455 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.474 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.47 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.402 HD12 ' CD2' ' A' ' 125' ' ' TYR . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.485 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.435 HG23 HD11 ' A' ' 39' ' ' ILE . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.479 ' HD3' ' OG ' ' A' ' 123' ' ' SER . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.406 ' CD1' HG23 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.457 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.42 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.42 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.438 HG21 HD12 ' A' ' 75' ' ' ILE . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.456 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA2' ' A' ' 92' ' ' GLY . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.427 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.401 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 96' ' ' TYR . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.43 ' HB3' ' CD2' ' A' ' 139' ' ' LEU . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.456 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.479 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.402 ' CD2' HD12 ' A' ' 37' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.481 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.455 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.483 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.481 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 19.2 m-70 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.43 ' CD2' ' HB3' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.834 0.349 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.71 168.22 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.191 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -102.3 -26.79 13.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.095 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -59.09 144.48 82.66 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.876 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.58 -67.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.468 2.112 . . . . 0.0 112.293 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.1 p -151.86 148.72 28.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.072 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.67 -51.94 3.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.004 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.52 69.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.194 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' CE2' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.486 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.426 ' HA ' HG23 ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.406 ' CD1' ' CG2' ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.46 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.46 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.461 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 75' ' ' ILE . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.412 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.445 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.406 HG13 ' HD2' ' A' ' 89' ' ' PRO . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.406 ' HD2' HG13 ' A' ' 88' ' ' VAL . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.426 HG23 ' HA ' ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.437 HG13 ' N ' ' A' ' 96' ' ' TYR . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.459 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.528 HD21 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.479 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.528 ' CD2' HD21 ' A' ' 126' ' ' LEU . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.4 mmm . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 168.37 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.17 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.31 -26.8 28.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.051 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -58.47 146.61 72.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.699 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -55.18 -74.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.328 2.019 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.7 p -163.06 140.49 7.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.87 0.367 . . . . 0.0 111.153 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.16 -39.79 10.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.953 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.18 71.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.421 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.44 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.427 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.405 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.409 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.455 ' CD2' ' CE1' ' A' ' 125' ' ' TYR . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.412 ' CD1' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.457 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.457 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.421 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.412 HG21 ' CD1' ' A' ' 56' ' ' PHE . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.433 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.433 ' CD1' ' HA ' ' A' ' 81' ' ' ARG . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.427 HG11 ' HD2' ' A' ' 89' ' ' PRO . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.427 ' HD2' HG11 ' A' ' 88' ' ' VAL . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.457 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.422 ' HA2' HG12 ' A' ' 88' ' ' VAL . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.427 ' N ' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.446 HG11 ' N ' ' A' ' 96' ' ' TYR . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 108' ' ' LYS . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.452 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 20' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.521 ' HB3' ' HG ' ' A' ' 139' ' ' LEU . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.457 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.401 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.409 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.455 ' CE1' ' CD2' ' A' ' 52' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.475 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.444 ' CD2' HD23 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.521 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.525 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 3.4 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.091 0.472 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.525 ' N ' ' HG3' ' A' ' 1' ' ' MET . . . -87.91 168.33 12.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.472 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -84.27 -26.87 28.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.863 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -115.33 149.95 43.66 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.29 -95.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.351 2.034 . . . . 0.0 112.043 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 p -155.33 150.13 26.5 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.914 0.387 . . . . 0.0 111.297 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.7 -53.24 3.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.862 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.52 -29.0 70.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.839 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.431 ' O ' HG21 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.431 HG21 ' O ' ' A' ' 11' ' ' ASN . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.459 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.459 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.403 ' HA ' ' HG3' ' A' ' 25' ' ' GLU . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.403 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.44 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.45 ' HA ' HG21 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 123' ' ' SER . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.409 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.409 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 0.6 OUTLIER -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.402 HD12 HG22 ' A' ' 75' ' ' ILE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.412 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.427 ' CD2' HD23 ' A' ' 93' ' ' LEU . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.434 HG12 ' N ' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HD2' HG13 ' A' ' 88' ' ' VAL . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.411 ' HA2' HG11 ' A' ' 88' ' ' VAL . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.434 ' N ' HG12 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.43 HG13 ' N ' ' A' ' 96' ' ' TYR . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.513 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.401 ' CE2' HD21 ' A' ' 20' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.419 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.513 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.462 ' CD2' HD22 ' A' ' 126' ' ' LEU . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.805 0.336 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.95 165.38 15.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.135 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -84.46 -24.02 29.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.851 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' PRO . 7.9 m-20 -55.27 150.31 22.83 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.41 ' O ' ' O ' ' A' ' 4' ' ' ASP . 48.4 Cg_exo -56.06 -143.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 122.86 2.374 . . . . 0.0 112.453 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 p -92.89 89.15 6.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.805 0.336 . . . . 0.0 110.935 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.87 -82.93 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.921 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -25.64 68.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.417 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.418 HD11 ' CE2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.465 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.465 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.445 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.449 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.401 ' HA ' HG12 ' A' ' 88' ' ' VAL . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.417 HD21 ' CE1' ' A' ' 125' ' ' TYR . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.478 ' HB3' ' CB ' ' A' ' 67' ' ' ASN . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.478 ' CB ' ' HB3' ' A' ' 64' ' ' SER . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.439 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.439 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.462 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.486 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 41' ' ' PRO . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 112' ' ' ILE . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.48 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.458 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.44 ' CE2' ' CD2' ' A' ' 20' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.411 ' HG3' ' CG1' ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.418 ' CE2' HD11 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.411 ' CG1' ' HG3' ' A' ' 116' ' ' PRO . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.417 ' CE1' HD21 ' A' ' 52' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.486 ' CD1' ' N ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . 0.408 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.48 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.434 ' CD2' HD22 ' A' ' 126' ' ' LEU . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.79 0.329 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.77 168.11 0.98 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.198 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -88.18 -26.65 22.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.068 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.59 150.01 37.58 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -48.59 -108.05 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.973 2.448 . . . . 0.0 112.602 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.3 p -144.49 146.36 32.37 Favored 'General case' 0 C--O 1.231 0.095 0 O-C-N 121.993 -0.442 . . . . 0.0 110.914 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.32 -52.89 3.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.004 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.7 -34.4 78.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.436 ' CD1' ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.463 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.463 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 22' ' ' LYS . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.419 HD22 ' CD2' ' A' ' 131' ' ' PHE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.419 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.469 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 94' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.418 ' O ' ' HA ' ' A' ' 123' ' ' SER . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.403 ' HA ' ' HD3' ' A' ' 40' ' ' PRO . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.407 ' HA ' ' O ' ' A' ' 120' ' ' ILE . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.458 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 67' ' ' ASN . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.435 ' HB3' ' HB3' ' A' ' 64' ' ' SER . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.458 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.441 HD13 HG22 ' A' ' 75' ' ' ILE . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.446 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.487 ' HD3' ' CD2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.487 ' CD2' ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.429 ' CD2' HD22 ' A' ' 93' ' ' LEU . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.42 HG11 ' N ' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.429 HD22 ' CD2' ' A' ' 85' ' ' TYR . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 37' ' ' LEU . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.447 HG13 ' N ' ' A' ' 96' ' ' TYR . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.49 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.403 ' HA ' ' HA2' ' A' ' 29' ' ' GLY . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.436 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.407 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . 0.402 ' CE2' ' OE1' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.509 ' CD2' ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.419 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PHE . . . . . 0.487 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . 0.509 ' CD2' ' CD2' ' A' ' 126' ' ' LEU . 94.4 m-70 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.592 ' O ' HG22 ' A' ' 14' ' ' ILE . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.926 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CH2' ' HD2' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HD2' ' CH2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.627 ' HA ' HD12 ' A' ' 24' ' ' LEU . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 21' ' ' ILE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.027 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.459 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.656 ' O ' HG23 ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.656 HG23 ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.459 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.719 HG21 HG21 ' A' ' 78' ' ' VAL . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.468 ' HB2' HD23 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 38' ' ' ILE . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.77 HD12 ' C ' ' A' ' 37' ' ' LEU . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.739 HG12 HG21 ' A' ' 48' ' ' VAL . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.582 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.459 HG23 HD22 ' A' ' 82' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.739 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.835 HD21 ' HB ' ' A' ' 78' ' ' VAL . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.768 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.708 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 62' ' ' ILE . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.881 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.708 ' HA ' HD12 ' A' ' 62' ' ' ILE . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 60' ' ' SER . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.487 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.811 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.835 ' HB ' HD21 ' A' ' 52' ' ' LEU . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.459 HD22 HG23 ' A' ' 45' ' ' ILE . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HG2' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.5 HD22 ' HG2' ' A' ' 83' ' ' LYS . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.833 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.405 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.833 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 38' ' ' ILE . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.667 HG13 ' O ' ' A' ' 112' ' ' ILE . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.419 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 1.027 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.667 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.454 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.405 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.4 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.926 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.579 ' O ' HD13 ' A' ' 120' ' ' ILE . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.579 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.41 ' HB3' ' HD3' ' A' ' 40' ' ' PRO . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.81 ' CD2' HD11 ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.702 ' C ' HD13 ' A' ' 126' ' ' LEU . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.81 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 32' ' ' THR . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.74 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.686 ' HA ' HG22 ' A' ' 137' ' ' THR . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 133' ' ' THR . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 134' ' ' GLU . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.63 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.815 0.341 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 14' ' ' ILE . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.734 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.616 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.616 HG23 ' O ' ' A' ' 17' ' ' ILE . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 131' ' ' PHE . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.905 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.588 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.688 HG23 ' HE1' ' A' ' 125' ' ' TYR . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.522 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD21 HG11 ' A' ' 48' ' ' VAL . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.743 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.592 HG12 HG21 ' A' ' 48' ' ' VAL . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.851 HG23 HD22 ' A' ' 82' ' ' LEU . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.592 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.429 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.9 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.596 ' H ' HG22 ' A' ' 62' ' ' ILE . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.906 ' O ' HG23 ' A' ' 71' ' ' VAL . 6.7 t-20 -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.893 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.643 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.713 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.9 HG23 ' CD1' ' A' ' 52' ' ' LEU . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.713 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.6 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.455 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.851 HD22 HG23 ' A' ' 45' ' ' ILE . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.474 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.811 HG13 ' HB2' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.406 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.811 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.743 HG22 ' HA ' ' A' ' 38' ' ' ILE . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.643 HG13 ' O ' ' A' ' 112' ' ' ILE . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.531 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.588 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.905 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.643 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.734 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.506 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.676 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.696 ' CE2' HD22 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.666 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.414 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.408 ' N ' HG22 ' A' ' 32' ' ' THR . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.666 ' ND1' HD22 ' A' ' 126' ' ' LEU . 37.6 m80 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.843 HG22 HD12 ' A' ' 136' ' ' LEU . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.843 HD12 HG22 ' A' ' 133' ' ' THR . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.638 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.64 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.781 0.324 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.508 ' O ' HG22 ' A' ' 14' ' ' ILE . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.508 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.413 ' CZ2' ' HE3' ' A' ' 19' ' ' LYS . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 21' ' ' ILE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 17' ' ' ILE . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.547 HD22 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.581 HG22 ' ND2' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.606 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.401 HD12 ' CB ' ' A' ' 74' ' ' ALA . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.477 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.714 HD21 HG11 ' A' ' 48' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.852 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.567 HG12 HG21 ' A' ' 48' ' ' VAL . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.466 ' HB3' HG22 ' A' ' 39' ' ' ILE . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.81 HG23 HD22 ' A' ' 82' ' ' LEU . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.714 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.405 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.955 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.781 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.627 ' H ' HG22 ' A' ' 62' ' ' ILE . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.737 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.476 HD21 ' NH2' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.647 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.955 HG23 HD12 ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.647 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.81 HD22 HG23 ' A' ' 45' ' ' ILE . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.819 HG13 ' HB2' ' A' ' 93' ' ' LEU . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.414 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.819 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.852 HG22 ' HA ' ' A' ' 38' ' ' ILE . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.499 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.606 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.655 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.414 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 1.023 ' HB3' HD21 ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.537 ' HB2' HD13 ' A' ' 139' ' ' LEU . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.652 ' N ' HD23 ' A' ' 124' ' ' LEU . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 34' ' ' MET . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.581 ' ND2' HG22 ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.547 ' CD2' HD22 ' A' ' 24' ' ' LEU . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.962 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.962 HD12 HG22 ' A' ' 133' ' ' THR . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 1.023 HD21 ' HB3' ' A' ' 117' ' ' PHE . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.579 ' O ' HD12 ' A' ' 17' ' ' ILE . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.759 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.418 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.579 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.802 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.685 HG22 ' OD1' ' A' ' 129' ' ' ASN . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.402 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.406 ' CD1' ' HB3' ' A' ' 74' ' ' ALA . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.485 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.772 HD21 HG11 ' A' ' 48' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.761 HD13 HD22 ' A' ' 124' ' ' LEU . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.694 HG12 HG21 ' A' ' 48' ' ' VAL . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.578 ' O ' HG11 ' A' ' 88' ' ' VAL . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.772 HG11 HD21 ' A' ' 37' ' ' LEU . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.068 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.807 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.581 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.646 ' CD1' HG21 ' A' ' 71' ' ' VAL . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.525 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.774 ' O ' HG23 ' A' ' 71' ' ' VAL . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 67' ' ' ASN . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.581 HD11 ' OG ' ' A' ' 60' ' ' SER . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.687 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 1.068 HG23 HD12 ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.717 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.717 HD23 ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.814 HG13 ' HB2' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.814 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.569 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 112' ' ' ILE . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.802 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.679 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.531 ' CB ' HG22 ' A' ' 95' ' ' VAL . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.433 ' O ' HD13 ' A' ' 120' ' ' ILE . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.516 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.827 ' CD2' HD11 ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.788 ' C ' HD13 ' A' ' 126' ' ' LEU . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.827 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' MET . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' OD1' HG22 ' A' ' 32' ' ' THR . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.467 ' CB ' ' HG1' ' A' ' 137' ' ' THR . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.798 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.6 ' O ' HD22 ' A' ' 139' ' ' LEU . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' A' ' 133' ' ' THR . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.556 HD11 HG13 ' A' ' 14' ' ' ILE . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.596 ' O ' HG22 ' A' ' 14' ' ' ILE . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.968 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.417 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.551 HD13 ' HD1' ' A' ' 117' ' ' PHE . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.45 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.774 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 99' ' ' THR . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.644 HD12 ' CB ' ' A' ' 74' ' ' ALA . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.651 HG23 ' CG2' ' A' ' 94' ' ' VAL . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' HB3' ' A' ' 43' ' ' ASP . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.603 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB3' HG22 ' A' ' 39' ' ' ILE . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.641 HG23 HD22 ' A' ' 82' ' ' LEU . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.464 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.719 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.82 ' HB2' HG21 ' A' ' 75' ' ' ILE . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.519 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.591 ' OG ' HD11 ' A' ' 72' ' ' LEU . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 68' ' ' ARG . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 69' ' ' LEU . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.728 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.591 HD11 ' OG ' ' A' ' 60' ' ' SER . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.644 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.82 HG21 ' HB2' ' A' ' 56' ' ' PHE . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 2.3 mm100 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.641 HD22 HG23 ' A' ' 45' ' ' ILE . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.493 ' HG2' HD23 ' A' ' 84' ' ' LEU . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.493 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.457 ' O ' HD12 ' A' ' 45' ' ' ILE . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.605 ' O ' HD11 ' A' ' 45' ' ' ILE . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.803 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.424 ' CD ' HD23 ' A' ' 93' ' ' LEU . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.421 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.803 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.651 ' CG2' HG23 ' A' ' 38' ' ' ILE . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.446 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 33' ' ' SER . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.521 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.968 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.471 ' O ' HD13 ' A' ' 120' ' ' ILE . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.674 ' C ' HD13 ' A' ' 126' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.557 ' SG ' HG22 ' A' ' 32' ' ' THR . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.774 ' HA ' HG23 ' A' ' 32' ' ' THR . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.444 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' HB2' HD21 ' A' ' 126' ' ' LEU . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.882 HG22 HD12 ' A' ' 136' ' ' LEU . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.574 ' HB3' ' CD1' ' A' ' 38' ' ' ILE . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.882 HD12 HG22 ' A' ' 133' ' ' THR . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.77 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.827 0.346 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.938 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.674 HG22 HG21 ' A' ' 133' ' ' THR . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.407 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.98 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.404 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.81 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' CB ' ' A' ' 74' ' ' ALA . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.532 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.667 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.406 HG22 ' HB3' ' A' ' 43' ' ' ASP . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.406 ' HB3' HG22 ' A' ' 39' ' ' ILE . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.599 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.449 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.701 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.811 ' HB2' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.705 ' OG ' HD11 ' A' ' 72' ' ' LEU . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.471 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.417 ' O ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.4 t-20 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 67' ' ' ASN . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.705 HD11 ' OG ' ' A' ' 60' ' ' SER . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.448 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' ' 56' ' ' PHE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.443 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.822 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.667 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.658 HG13 ' O ' ' A' ' 112' ' ' ILE . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.405 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.98 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.55 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.59 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.938 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.655 ' O ' HD13 ' A' ' 120' ' ' ILE . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.655 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.743 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.743 ' N ' HD23 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.664 HD22 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.671 ' SG ' HG22 ' A' ' 32' ' ' THR . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.81 ' HA ' HG23 ' A' ' 32' ' ' THR . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.431 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.664 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.644 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.575 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.867 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.489 HD12 ' CD1' ' A' ' 117' ' ' PHE . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' A' ' 20' ' ' LEU . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.967 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.654 HG22 ' ND2' ' A' ' 129' ' ' ASN . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.45 HD12 ' CB ' ' A' ' 74' ' ' ALA . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.543 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.784 HD21 HG11 ' A' ' 48' ' ' VAL . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.743 HG12 HG21 ' A' ' 48' ' ' VAL . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' CD ' ' O ' ' A' ' 120' ' ' ILE . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.418 HG23 HD22 ' A' ' 82' ' ' LEU . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.784 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.417 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.039 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.862 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.52 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.563 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.699 HD13 ' OD1' ' A' ' 67' ' ' ASN . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.53 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.6 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.408 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' OG ' ' A' ' 60' ' ' SER . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.688 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 1.039 HG23 HD12 ' A' ' 52' ' ' LEU . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.571 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.571 HD11 HG12 ' A' ' 48' ' ' VAL . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.501 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.427 HD21 ' HE3' ' A' ' 83' ' ' LYS . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.855 HG13 ' HB2' ' A' ' 93' ' ' LEU . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.413 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.855 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.804 HG22 ' HA ' ' A' ' 38' ' ' ILE . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.501 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.967 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.701 HG22 ' HG3' ' A' ' 107' ' ' GLU . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.701 ' HG3' HG22 ' A' ' 101' ' ' VAL . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.621 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.409 ' HG3' ' HB2' ' A' ' 89' ' ' PRO . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.481 ' CB ' HD11 ' A' ' 120' ' ' ILE . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.867 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.675 HG22 ' H ' ' A' ' 122' ' ' THR . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.675 ' H ' HG22 ' A' ' 120' ' ' ILE . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.656 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.656 ' N ' HD23 ' A' ' 124' ' ' LEU . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.634 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.654 ' ND2' HG22 ' A' ' 32' ' ' THR . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.488 ' HB2' HD21 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.041 HG22 HD12 ' A' ' 136' ' ' LEU . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.602 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.041 HD12 HG22 ' A' ' 133' ' ' THR . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.692 HD11 ' HD2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.66 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.635 ' O ' HG22 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.448 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.678 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.699 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.699 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.884 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 99' ' ' THR . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.702 HG21 HG21 ' A' ' 78' ' ' VAL . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.516 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.714 HG12 HG21 ' A' ' 48' ' ' VAL . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HD2' ' HB2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.792 HG23 HD22 ' A' ' 82' ' ' LEU . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.714 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.805 ' HB2' HG21 ' A' ' 75' ' ' ILE . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.479 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.593 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.664 HD12 ' HA ' ' A' ' 68' ' ' ARG . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.469 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.82 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.664 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.593 HD11 ' OG ' ' A' ' 60' ' ' SER . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.609 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.702 HG21 HG21 ' A' ' 35' ' ' ILE . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.455 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 3.5 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.469 ' NH1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.792 HD22 HG23 ' A' ' 45' ' ' ILE . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.469 HD11 ' NH1' ' A' ' 81' ' ' ARG . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.82 HG13 ' HB2' ' A' ' 93' ' ' LEU . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.465 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.82 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 112' ' ' ILE . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.516 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.402 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 33' ' ' SER . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.581 HG23 ' HG3' ' A' ' 108' ' ' LYS . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.581 ' HG3' HG23 ' A' ' 102' ' ' THR . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.734 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.678 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HD3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.721 ' O ' HD13 ' A' ' 120' ' ' ILE . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.721 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.794 HD23 ' N ' ' A' ' 125' ' ' TYR . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.794 ' N ' HD23 ' A' ' 124' ' ' LEU . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.499 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.637 ' SG ' HG22 ' A' ' 32' ' ' THR . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.884 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.421 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.499 ' ND1' HD22 ' A' ' 126' ' ' LEU . 9.7 m80 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.885 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.577 ' HA ' HG22 ' A' ' 137' ' ' THR . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.885 HD12 HG22 ' A' ' 133' ' ' THR . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.577 HG22 ' HA ' ' A' ' 134' ' ' GLU . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.643 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.721 0.296 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.577 ' O ' HG22 ' A' ' 14' ' ' ILE . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.727 HD12 ' HZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.868 ' HD3' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.576 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.868 HD12 ' HD3' ' A' ' 16' ' ' LYS . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 17' ' ' ILE . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 21' ' ' ILE . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.415 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.617 HD12 ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.481 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.604 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.814 HG12 HG21 ' A' ' 48' ' ' VAL . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.754 HG23 HD22 ' A' ' 82' ' ' LEU . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.814 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.917 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.822 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.813 HD12 ' HA ' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.436 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.439 ' O ' HD13 ' A' ' 69' ' ' LEU . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.9 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.2 t-20 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 65' ' ' ARG . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.9 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.448 HD11 ' OG ' ' A' ' 60' ' ' SER . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.617 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.917 HG23 HD12 ' A' ' 52' ' ' LEU . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 74' ' ' ALA . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.481 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.754 HD22 HG23 ' A' ' 45' ' ' ILE . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.508 ' HE3' HD21 ' A' ' 84' ' ' LEU . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.508 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.604 HG22 ' HA ' ' A' ' 38' ' ' ILE . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 112' ' ' ILE . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.509 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.422 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.67 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.498 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.432 ' O ' HD13 ' A' ' 120' ' ' ILE . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.432 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.55 ' SG ' HG22 ' A' ' 32' ' ' THR . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.822 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.509 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.904 HG22 HD12 ' A' ' 136' ' ' LEU . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.904 HD12 HG22 ' A' ' 133' ' ' THR . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.613 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.403 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.711 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.53 HG22 ' CG ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.447 ' HE1' HG23 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.458 HD12 ' CB ' ' A' ' 74' ' ' ALA . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.692 HD21 HG11 ' A' ' 48' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.86 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.689 ' CD1' HG21 ' A' ' 48' ' ' VAL . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.6 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.443 ' HB3' HG22 ' A' ' 39' ' ' ILE . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.692 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.411 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.888 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.755 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.527 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.452 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.751 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t-20 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.816 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 68' ' ' ARG . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.428 HD11 ' OG ' ' A' ' 60' ' ' SER . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.888 HG23 ' CD1' ' A' ' 52' ' ' LEU . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.84 ' HB ' HD21 ' A' ' 52' ' ' LEU . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 52' ' ' LEU . 9.6 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.505 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 83' ' ' LYS . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.802 HG13 ' HB2' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.41 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.802 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.86 HG22 ' HA ' ' A' ' 38' ' ' ILE . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 112' ' ' ILE . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.503 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.583 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.435 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.68 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.459 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.445 ' HD3' HG23 ' A' ' 94' ' ' VAL . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.533 ' CE2' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 120' ' ' ILE . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 119' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.485 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.683 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.684 ' HD2' HD13 ' A' ' 37' ' ' LEU . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.53 ' CG ' HG22 ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.503 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.691 HG22 HD12 ' A' ' 136' ' ' LEU . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.691 HD12 HG22 ' A' ' 133' ' ' THR . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.594 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 14' ' ' ILE . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.783 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.931 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.783 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 112' ' ' ILE . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.415 HG13 ' N ' ' A' ' 22' ' ' LYS . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' N ' HG13 ' A' ' 21' ' ' ILE . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.813 HD22 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.571 ' C ' HG22 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.44 ' N ' HG22 ' A' ' 100' ' ' ILE . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.436 HG22 ' OD1' ' A' ' 129' ' ' ASN . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.427 ' CE ' HG23 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.661 HG23 ' HE1' ' A' ' 125' ' ' TYR . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.503 ' HB3' HD23 ' A' ' 126' ' ' LEU . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.651 ' C ' HD12 ' A' ' 38' ' ' ILE . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.682 HD13 HD22 ' A' ' 124' ' ' LEU . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.641 ' CD1' HG21 ' A' ' 48' ' ' VAL . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.593 ' O ' HG11 ' A' ' 88' ' ' VAL . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.538 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.622 HG21 ' O ' ' A' ' 85' ' ' TYR . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.485 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 1.003 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.857 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.8 HD13 ' OD1' ' A' ' 67' ' ' ASN . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.458 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.891 ' O ' HG23 ' A' ' 71' ' ' VAL . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.891 HG23 ' O ' ' A' ' 67' ' ' ASN . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.549 HD11 ' OG ' ' A' ' 60' ' ' SER . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 1.003 HG23 HD12 ' A' ' 52' ' ' LEU . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.6 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 79' ' ' GLN . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.622 ' O ' HG21 ' A' ' 45' ' ' ILE . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 93' ' ' LEU . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.571 HG22 ' C ' ' A' ' 28' ' ' ARG . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.794 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.479 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.931 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.699 ' O ' HD13 ' A' ' 120' ' ' ILE . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.699 HD13 ' O ' ' A' ' 119' ' ' PRO . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.776 ' C ' HD13 ' A' ' 126' ' ' LEU . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.436 ' OD1' HG22 ' A' ' 32' ' ' THR . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.813 ' CD2' HD22 ' A' ' 24' ' ' LEU . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.702 HG22 HD12 ' A' ' 136' ' ' LEU . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.794 HD11 ' HZ ' ' A' ' 114' ' ' PHE . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.567 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.866 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' A' ' 24' ' ' LEU . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.885 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.406 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.473 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.443 HG23 ' HE1' ' A' ' 125' ' ' TYR . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.675 HD21 HG11 ' A' ' 48' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.629 ' HA ' HG22 ' A' ' 94' ' ' VAL . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.752 HG12 HG21 ' A' ' 48' ' ' VAL . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.591 ' O ' HG11 ' A' ' 88' ' ' VAL . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.424 ' HB3' HG22 ' A' ' 39' ' ' ILE . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.401 HG21 ' O ' ' A' ' 85' ' ' TYR . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.752 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.61 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 71' ' ' VAL . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.554 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.61 HD11 ' OG ' ' A' ' 60' ' ' SER . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 74' ' ' ALA . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.426 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.43 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.401 ' O ' HG21 ' A' ' 45' ' ' ILE . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.835 HG13 ' HB2' ' A' ' 93' ' ' LEU . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.457 ' CD ' HD23 ' A' ' 93' ' ' LEU . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.835 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 38' ' ' ILE . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 112' ' ' ILE . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.477 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.406 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.885 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' OD1' ' A' ' 30' ' ' ASN . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.423 ' HG3' HG22 ' A' ' 101' ' ' VAL . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.49 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.635 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.866 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.593 ' O ' HD13 ' A' ' 120' ' ' ILE . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.593 HD13 ' O ' ' A' ' 119' ' ' PRO . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.413 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.608 HD22 HD12 ' A' ' 126' ' ' LEU . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.443 ' HE1' HG23 ' A' ' 35' ' ' ILE . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.627 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.46 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.477 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.476 ' HB2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.04 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.657 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.04 HD12 HG22 ' A' ' 133' ' ' THR . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.657 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.767 0.318 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.608 ' O ' HG22 ' A' ' 14' ' ' ILE . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' HD12 ' A' ' 17' ' ' ILE . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.904 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.744 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.893 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.566 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.494 HG22 ' CG ' ' A' ' 129' ' ' ASN . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' C ' ' A' ' 74' ' ' ALA . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.505 HD21 HG11 ' A' ' 48' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.82 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 HD12 ' A' ' 93' ' ' LEU . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.743 HD11 ' O ' ' A' ' 87' ' ' LYS . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.505 HG11 HD21 ' A' ' 37' ' ' LEU . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.45 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.95 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.806 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.61 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.525 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.704 HD13 ' OD1' ' A' ' 67' ' ' ASN . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 62' ' ' ILE . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.704 ' OD1' HD13 ' A' ' 62' ' ' ILE . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.632 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 59' ' ' ALA . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.525 HD11 ' OG ' ' A' ' 60' ' ' SER . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.95 HG23 HD12 ' A' ' 52' ' ' LEU . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.502 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.706 HD22 HG23 ' A' ' 45' ' ' ILE . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.601 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.445 ' HB2' HD13 ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.743 ' O ' HD11 ' A' ' 45' ' ' ILE . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.848 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.438 ' CD ' HD23 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.465 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.848 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.82 HG22 ' HA ' ' A' ' 38' ' ' ILE . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.566 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.626 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.449 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.564 ' CB ' HD11 ' A' ' 120' ' ' ILE . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.904 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' CB ' ' HD2' ' A' ' 119' ' ' PRO . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 118' ' ' LYS . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.666 HG22 ' H ' ' A' ' 122' ' ' THR . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.666 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.705 HD13 ' OE2' ' A' ' 134' ' ' GLU . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.64 ' N ' HD23 ' A' ' 124' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.642 ' O ' HD22 ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.494 ' CG ' HG22 ' A' ' 32' ' ' THR . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.893 ' CD2' HD22 ' A' ' 24' ' ' LEU . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.425 ' HB2' HD21 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.83 HG22 HD12 ' A' ' 136' ' ' LEU . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.705 ' OE2' HD13 ' A' ' 124' ' ' LEU . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.83 HD12 HG22 ' A' ' 133' ' ' THR . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.503 HG22 ' HG ' ' A' ' 141' ' ' SER . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.765 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.536 HD11 HG13 ' A' ' 14' ' ' ILE . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' SER . . . . . 0.503 ' HG ' HG22 ' A' ' 137' ' ' THR . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.659 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.672 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.813 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.426 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 17' ' ' ILE . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 131' ' ' PHE . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.003 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.739 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.409 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.526 HD12 ' CB ' ' A' ' 74' ' ' ALA . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.495 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.753 HD21 HG11 ' A' ' 48' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.657 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.827 HG12 HG21 ' A' ' 48' ' ' VAL . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.601 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.548 HG23 HD22 ' A' ' 82' ' ' LEU . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.629 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.827 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.509 ' HE1' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.764 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.636 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 68' ' ' ARG . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' 62' ' ' ILE . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.407 ' O ' HD13 ' A' ' 69' ' ' LEU . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.88 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.681 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 67' ' ' ASN . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.636 HD11 ' OG ' ' A' ' 60' ' ' SER . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.526 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.764 HG23 ' CD1' ' A' ' 52' ' ' LEU . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' ALA . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.577 ' OE1' HG22 ' A' ' 75' ' ' ILE . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.548 HD22 HG23 ' A' ' 45' ' ' ILE . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.701 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.818 HG13 ' HB2' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.416 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 38' ' ' ILE . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 ' O ' ' A' ' 112' ' ' ILE . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 1.003 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.487 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.497 ' HD3' HG23 ' A' ' 94' ' ' VAL . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.813 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.628 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.618 ' SG ' HG22 ' A' ' 32' ' ' THR . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.739 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.401 ' C ' ' HG3' ' A' ' 34' ' ' MET . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.589 ' CD2' HD22 ' A' ' 24' ' ' LEU . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.966 HG22 HD12 ' A' ' 136' ' ' LEU . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.578 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.966 HD12 HG22 ' A' ' 133' ' ' THR . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.485 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.813 0.339 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.571 ' O ' HG22 ' A' ' 14' ' ' ILE . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.791 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.551 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.727 ' HA ' HD12 ' A' ' 24' ' ' LEU . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 21' ' ' ILE . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.857 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.418 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.892 HG22 ' OD1' ' A' ' 129' ' ' ASN . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.417 HD13 ' OH ' ' A' ' 125' ' ' TYR . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.492 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 48' ' ' VAL . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 124' ' ' LEU . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.59 HG12 HG21 ' A' ' 48' ' ' VAL . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.59 ' O ' HG11 ' A' ' 88' ' ' VAL . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.63 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.59 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.443 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.871 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.8 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.402 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.523 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.831 HD12 ' HA ' ' A' ' 68' ' ' ARG . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.556 ' H ' HG22 ' A' ' 62' ' ' ILE . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.852 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.831 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.407 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 67' ' ' ASN . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.523 HD11 ' OG ' ' A' ' 60' ' ' SER . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.871 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 52' ' ' LEU . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.412 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.436 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.746 HD23 ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 93' ' ' LEU . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CD ' HD23 ' A' ' 93' ' ' LEU . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.836 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.857 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.418 HG21 ' OD1' ' A' ' 30' ' ' ASN . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.401 HG21 ' HE2' ' A' ' 108' ' ' LYS . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HE2' HG21 ' A' ' 102' ' ' THR . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.403 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.586 ' HG3' HG23 ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.436 ' O ' HD13 ' A' ' 120' ' ' ILE . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.512 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 38' ' ' ILE . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.704 ' N ' HD23 ' A' ' 124' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.439 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.892 ' OD1' HG22 ' A' ' 32' ' ' THR . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.439 ' ND1' HD22 ' A' ' 126' ' ' LEU . 10.2 m80 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.957 HG22 HD12 ' A' ' 136' ' ' LEU . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.957 HD12 HG22 ' A' ' 133' ' ' THR . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.751 0.31 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 14' ' ' ILE . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.701 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.832 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.431 HG23 ' O ' ' A' ' 17' ' ' ILE . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.639 HG22 ' CG ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.403 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.655 HD12 ' CB ' ' A' ' 74' ' ' ALA . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.68 HD21 ' CG1' ' A' ' 48' ' ' VAL . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.679 HG23 ' CG2' ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.742 ' CD1' HG21 ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.496 HG21 ' O ' ' A' ' 85' ' ' TYR . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.457 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.742 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.981 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.837 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.836 HD12 ' HA ' ' A' ' 68' ' ' ARG . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.564 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.451 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.836 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.732 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.981 HG23 HD12 ' A' ' 52' ' ' LEU . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 74' ' ' ALA . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.605 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.676 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.676 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.496 ' O ' HG21 ' A' ' 45' ' ' ILE . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.679 ' CG2' HG23 ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.683 HG23 HD11 ' A' ' 93' ' ' LEU . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.669 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.526 HG21 ' NZ ' ' A' ' 108' ' ' LYS . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.526 ' NZ ' HG21 ' A' ' 102' ' ' THR . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.4 ' HB2' ' NH1' ' A' ' 81' ' ' ARG . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.618 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.443 ' HG3' HG23 ' A' ' 94' ' ' VAL . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.832 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.53 ' O ' HD13 ' A' ' 120' ' ' ILE . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.53 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.664 HD22 HD12 ' A' ' 126' ' ' LEU . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.496 ' N ' HD23 ' A' ' 124' ' ' LEU . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.639 ' CG ' HG22 ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.488 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.619 HG22 HD12 ' A' ' 136' ' ' LEU . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.644 ' O ' HD22 ' A' ' 139' ' ' LEU . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 14' ' ' ILE . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.549 ' O ' HD12 ' A' ' 17' ' ' ILE . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.774 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 17' ' ' ILE . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.466 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.955 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.772 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' MET . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.496 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.62 HG21 HG21 ' A' ' 78' ' ' VAL . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.74 HD21 HG11 ' A' ' 48' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.641 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.775 HG12 HG21 ' A' ' 48' ' ' VAL . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.568 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.601 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.775 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.455 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.948 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.625 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 68' ' ' ARG . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.573 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.892 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.571 HD21 ' NH2' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 67' ' ' ASN . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.625 HD11 ' OG ' ' A' ' 60' ' ' SER . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.948 HG23 HD12 ' A' ' 52' ' ' LEU . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 HG21 ' A' ' 35' ' ' ILE . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.839 HG13 ' HB2' ' A' ' 93' ' ' LEU . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.839 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 38' ' ' ILE . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.955 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.42 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.774 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.706 ' O ' HD13 ' A' ' 120' ' ' ILE . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.706 HD13 ' O ' ' A' ' 119' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.595 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.595 ' N ' HD23 ' A' ' 124' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.63 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.581 ' SG ' HG22 ' A' ' 32' ' ' THR . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' THR . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.416 ' C ' ' HG3' ' A' ' 34' ' ' MET . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.496 ' CZ ' ' HE2' ' A' ' 34' ' ' MET . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.486 ' HB2' HD21 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.671 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.605 ' HB2' ' OE2' ' A' ' 134' ' ' GLU . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.768 0.318 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.721 ' O ' HG22 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.895 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.458 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.717 ' HA ' HD12 ' A' ' 24' ' ' LEU . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.659 ' N ' HD12 ' A' ' 21' ' ' ILE . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.013 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.4 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.629 HD12 ' CB ' ' A' ' 74' ' ' ALA . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD22 HG11 ' A' ' 78' ' ' VAL . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.601 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.587 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.453 HG23 HD22 ' A' ' 82' ' ' LEU . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.487 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.758 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.877 ' HB2' HG21 ' A' ' 75' ' ' ILE . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.658 HD12 ' HA ' ' A' ' 68' ' ' ARG . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 69' ' ' LEU . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.819 ' O ' HG23 ' A' ' 71' ' ' VAL . 8.8 t-20 -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.658 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.617 HD22 ' HG2' ' A' ' 68' ' ' ARG . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 67' ' ' ASN . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.629 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.877 HG21 ' HB2' ' A' ' 56' ' ' PHE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.453 HD22 HG23 ' A' ' 45' ' ' ILE . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.843 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.412 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.843 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.601 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.523 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 1.013 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.65 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.433 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.601 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.477 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.895 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.675 ' O ' HD13 ' A' ' 120' ' ' ILE . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 119' ' ' PRO . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.449 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.616 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.616 ' N ' HD23 ' A' ' 124' ' ' LEU . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.435 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.036 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.036 HD12 HG22 ' A' ' 133' ' ' THR . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.412 ' HA ' HD13 ' A' ' 140' ' ' LEU . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.666 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.711 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.486 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.421 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.84 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.439 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 21' ' ' ILE . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 33' ' ' SER . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.821 HG23 ' HA ' ' A' ' 128' ' ' ASP . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.48 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.58 HD12 ' CB ' ' A' ' 74' ' ' ALA . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.653 HD21 HG11 ' A' ' 48' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.67 HG12 HG21 ' A' ' 48' ' ' VAL . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.806 HG23 HD22 ' A' ' 82' ' ' LEU . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.621 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.67 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.438 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.455 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 68' ' ' ARG . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.586 ' H ' HG22 ' A' ' 62' ' ' ILE . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.874 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.796 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.429 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.455 HD21 ' OG ' ' A' ' 60' ' ' SER . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.58 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG21 ' A' ' 35' ' ' ILE . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.482 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.806 HD22 HG23 ' A' ' 45' ' ' ILE . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.847 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.847 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.761 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.677 HG22 ' CB ' ' A' ' 113' ' ' ASP . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.49 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.677 ' CB ' HG22 ' A' ' 95' ' ' VAL . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.483 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.489 ' CB ' HD11 ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.71 HG22 ' H ' ' A' ' 122' ' ' THR . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.71 ' H ' HG22 ' A' ' 120' ' ' ILE . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.4 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.614 HD22 HD12 ' A' ' 126' ' ' LEU . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.607 ' N ' HD23 ' A' ' 124' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.625 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' HG22 ' A' ' 32' ' ' THR . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.821 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.424 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' THR . . . . . 0.796 HG22 HD12 ' A' ' 136' ' ' LEU . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.796 HD12 HG22 ' A' ' 133' ' ' THR . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.566 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 140' ' ' LEU . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.831 0.348 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 14' ' ' ILE . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 17' ' ' ILE . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.922 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.579 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.595 HG22 ' CG ' ' A' ' 129' ' ' ASN . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.484 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.727 HG23 ' HE1' ' A' ' 125' ' ' TYR . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD21 HG11 ' A' ' 48' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.668 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 93' ' ' LEU . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.4 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.608 HG21 HG12 ' A' ' 39' ' ' ILE . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.436 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.898 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.476 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.457 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.597 ' OD1' HD13 ' A' ' 62' ' ' ILE . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.786 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ASN . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.898 HG23 HD12 ' A' ' 52' ' ' LEU . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.605 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.605 HD23 ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.405 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.829 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.626 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 94' ' ' VAL . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.922 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.423 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.545 ' C ' HD23 ' A' ' 124' ' ' LEU . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.727 ' HE1' HG23 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASN . . . . . 0.595 ' CG ' HG22 ' A' ' 32' ' ' THR . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PHE . . . . . 0.529 ' CD2' HD22 ' A' ' 24' ' ' LEU . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' HIS . . . . . 0.609 ' ND1' HD22 ' A' ' 126' ' ' LEU . 63.9 m80 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' THR . . . . . 1.052 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.66 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 1.052 HD12 HG22 ' A' ' 133' ' ' THR . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.532 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.569 HD21 HD11 ' A' ' 14' ' ' ILE . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.27 153.81 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.142 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -99.78 8.49 44.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.331 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -69.04 149.88 97.68 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.688 0.28 . . . . 0.0 110.926 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.47 -30.39 92.42 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.592 2.195 . . . . 0.0 112.17 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p 170.89 77.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.896 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.18 -87.28 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.479 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.66 -26.84 68.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.592 ' O ' HG22 ' A' ' 14' ' ' ILE . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.926 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CH2' ' HD2' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HD2' ' CH2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.627 ' HA ' HD12 ' A' ' 24' ' ' LEU . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 21' ' ' ILE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.027 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.459 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.656 ' O ' HG23 ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.656 HG23 ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.459 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.719 HG21 HG21 ' A' ' 78' ' ' VAL . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.468 ' HB2' HD23 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 38' ' ' ILE . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.77 HD12 ' C ' ' A' ' 37' ' ' LEU . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.739 HG12 HG21 ' A' ' 48' ' ' VAL . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.582 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.459 HG23 HD22 ' A' ' 82' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.739 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.835 HD21 ' HB ' ' A' ' 78' ' ' VAL . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.768 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.708 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 62' ' ' ILE . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.881 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.708 ' HA ' HD12 ' A' ' 62' ' ' ILE . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 60' ' ' SER . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.487 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.811 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.835 ' HB ' HD21 ' A' ' 52' ' ' LEU . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.459 HD22 HG23 ' A' ' 45' ' ' ILE . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HG2' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.5 HD22 ' HG2' ' A' ' 83' ' ' LYS . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.833 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.405 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.833 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 38' ' ' ILE . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.667 HG13 ' O ' ' A' ' 112' ' ' ILE . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.419 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 1.027 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.667 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.454 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.405 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.4 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.926 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.579 ' O ' HD13 ' A' ' 120' ' ' ILE . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.579 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.41 ' HB3' ' HD3' ' A' ' 40' ' ' PRO . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.81 ' CD2' HD11 ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.702 ' C ' HD13 ' A' ' 126' ' ' LEU . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.81 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 32' ' ' THR . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.74 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.686 ' HA ' HG22 ' A' ' 137' ' ' THR . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 133' ' ' THR . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 134' ' ' GLU . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.63 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.831 0.348 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.25 168.33 4.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -92.11 -26.86 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.52 146.11 41.07 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.835 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -68.12 -87.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.469 2.112 . . . . 0.0 112.397 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.6 p 174.12 136.27 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.706 0.289 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.64 -40.34 95.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.276 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.76 -31.62 70.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.113 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 14' ' ' ILE . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.734 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.616 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.616 HG23 ' O ' ' A' ' 17' ' ' ILE . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 131' ' ' PHE . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.905 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.588 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.688 HG23 ' HE1' ' A' ' 125' ' ' TYR . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.522 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD21 HG11 ' A' ' 48' ' ' VAL . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.743 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.592 HG12 HG21 ' A' ' 48' ' ' VAL . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.851 HG23 HD22 ' A' ' 82' ' ' LEU . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.592 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.429 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.9 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.596 ' H ' HG22 ' A' ' 62' ' ' ILE . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.906 ' O ' HG23 ' A' ' 71' ' ' VAL . 6.7 t-20 -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.893 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.643 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.713 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.9 HG23 ' CD1' ' A' ' 52' ' ' LEU . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.713 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.6 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.455 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.851 HD22 HG23 ' A' ' 45' ' ' ILE . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.474 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.811 HG13 ' HB2' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.406 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.811 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.743 HG22 ' HA ' ' A' ' 38' ' ' ILE . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.643 HG13 ' O ' ' A' ' 112' ' ' ILE . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.531 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.588 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.905 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.643 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.734 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.506 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.676 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.696 ' CE2' HD22 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.666 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.414 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.408 ' N ' HG22 ' A' ' 32' ' ' THR . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.666 ' ND1' HD22 ' A' ' 126' ' ' LEU . 37.6 m80 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.843 HG22 HD12 ' A' ' 136' ' ' LEU . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.843 HD12 HG22 ' A' ' 133' ' ' THR . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.638 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.64 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.799 0.333 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.76 169.13 12.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.103 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -83.78 2.14 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.286 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -75.79 150.27 83.81 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.4 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -40.05 -81.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.678 2.252 . . . . 0.0 112.68 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' ASP . 59.6 p -127.99 146.6 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 111.012 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.55 -68.99 0.88 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.15 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.83 -29.81 67.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.508 ' O ' HG22 ' A' ' 14' ' ' ILE . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.508 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.413 ' CZ2' ' HE3' ' A' ' 19' ' ' LYS . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 21' ' ' ILE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 17' ' ' ILE . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.547 HD22 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.581 HG22 ' ND2' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.606 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.401 HD12 ' CB ' ' A' ' 74' ' ' ALA . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.477 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.714 HD21 HG11 ' A' ' 48' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.852 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.567 HG12 HG21 ' A' ' 48' ' ' VAL . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.466 ' HB3' HG22 ' A' ' 39' ' ' ILE . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.81 HG23 HD22 ' A' ' 82' ' ' LEU . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.714 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.405 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.955 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.781 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.627 ' H ' HG22 ' A' ' 62' ' ' ILE . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.737 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.476 HD21 ' NH2' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.647 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.955 HG23 HD12 ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.647 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.81 HD22 HG23 ' A' ' 45' ' ' ILE . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.819 HG13 ' HB2' ' A' ' 93' ' ' LEU . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.414 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.819 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.852 HG22 ' HA ' ' A' ' 38' ' ' ILE . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.499 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.606 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.655 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.414 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 1.023 ' HB3' HD21 ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.537 ' HB2' HD13 ' A' ' 139' ' ' LEU . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.652 ' N ' HD23 ' A' ' 124' ' ' LEU . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 34' ' ' MET . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.581 ' ND2' HG22 ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.547 ' CD2' HD22 ' A' ' 24' ' ' LEU . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.962 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.962 HD12 HG22 ' A' ' 133' ' ' THR . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 1.023 HD21 ' HB3' ' A' ' 117' ' ' PHE . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.755 0.312 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.727 ' HB3' ' OD1' ' A' ' 4' ' ' ASP . . . -57.43 168.37 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.01 0.433 . . . . 0.0 111.354 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -86.89 8.9 21.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.706 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.727 ' OD1' ' HB3' ' A' ' 2' ' ' ALA . 2.0 p-10 -53.43 133.16 53.43 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.628 0.251 . . . . 0.0 111.068 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 16.0 Cg_exo -67.81 -10.55 29.18 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.731 2.287 . . . . 0.0 112.888 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 5.8 p 165.94 80.48 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.791 0.329 . . . . 0.0 110.896 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB2' ' OD2' ' A' ' 4' ' ' ASP . . . -68.69 -87.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.23 -24.3 67.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.579 ' O ' HD12 ' A' ' 17' ' ' ILE . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.759 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.418 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.579 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.802 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.685 HG22 ' OD1' ' A' ' 129' ' ' ASN . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.402 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.406 ' CD1' ' HB3' ' A' ' 74' ' ' ALA . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.485 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.772 HD21 HG11 ' A' ' 48' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.761 HD13 HD22 ' A' ' 124' ' ' LEU . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.694 HG12 HG21 ' A' ' 48' ' ' VAL . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.578 ' O ' HG11 ' A' ' 88' ' ' VAL . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.772 HG11 HD21 ' A' ' 37' ' ' LEU . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.068 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.807 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.581 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.646 ' CD1' HG21 ' A' ' 71' ' ' VAL . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.525 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.774 ' O ' HG23 ' A' ' 71' ' ' VAL . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 67' ' ' ASN . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.581 HD11 ' OG ' ' A' ' 60' ' ' SER . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.687 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 1.068 HG23 HD12 ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.717 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.717 HD23 ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.814 HG13 ' HB2' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.814 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.569 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 112' ' ' ILE . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.802 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.679 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.531 ' CB ' HG22 ' A' ' 95' ' ' VAL . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.433 ' O ' HD13 ' A' ' 120' ' ' ILE . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.516 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.827 ' CD2' HD11 ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.788 ' C ' HD13 ' A' ' 126' ' ' LEU . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.827 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' MET . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' OD1' HG22 ' A' ' 32' ' ' THR . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.467 ' CB ' ' HG1' ' A' ' 137' ' ' THR . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.798 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.6 ' O ' HD22 ' A' ' 139' ' ' LEU . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' A' ' 133' ' ' THR . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.556 HD11 HG13 ' A' ' 14' ' ' ILE . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.66 167.49 7.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -89.5 8.47 30.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.335 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.29 150.01 70.14 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.85 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.33 -27.24 47.4 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.645 2.23 . . . . 0.0 112.071 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p 173.85 76.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.56 -86.14 0.06 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.481 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.54 -22.98 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.596 ' O ' HG22 ' A' ' 14' ' ' ILE . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.968 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.417 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.551 HD13 ' HD1' ' A' ' 117' ' ' PHE . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.45 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.774 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 99' ' ' THR . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.644 HD12 ' CB ' ' A' ' 74' ' ' ALA . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.651 HG23 ' CG2' ' A' ' 94' ' ' VAL . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' HB3' ' A' ' 43' ' ' ASP . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.603 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB3' HG22 ' A' ' 39' ' ' ILE . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.641 HG23 HD22 ' A' ' 82' ' ' LEU . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.464 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.719 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.82 ' HB2' HG21 ' A' ' 75' ' ' ILE . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.519 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.591 ' OG ' HD11 ' A' ' 72' ' ' LEU . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 68' ' ' ARG . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 69' ' ' LEU . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.728 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.591 HD11 ' OG ' ' A' ' 60' ' ' SER . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.644 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.82 HG21 ' HB2' ' A' ' 56' ' ' PHE . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 2.3 mm100 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.641 HD22 HG23 ' A' ' 45' ' ' ILE . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.493 ' HG2' HD23 ' A' ' 84' ' ' LEU . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.493 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.457 ' O ' HD12 ' A' ' 45' ' ' ILE . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.605 ' O ' HD11 ' A' ' 45' ' ' ILE . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.803 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.424 ' CD ' HD23 ' A' ' 93' ' ' LEU . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.421 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.803 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.651 ' CG2' HG23 ' A' ' 38' ' ' ILE . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.446 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 33' ' ' SER . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.521 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.968 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.471 ' O ' HD13 ' A' ' 120' ' ' ILE . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.674 ' C ' HD13 ' A' ' 126' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.557 ' SG ' HG22 ' A' ' 32' ' ' THR . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.774 ' HA ' HG23 ' A' ' 32' ' ' THR . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.444 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' HB2' HD21 ' A' ' 126' ' ' LEU . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.882 HG22 HD12 ' A' ' 136' ' ' LEU . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.574 ' HB3' ' CD1' ' A' ' 38' ' ' ILE . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.882 HD12 HG22 ' A' ' 133' ' ' THR . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.77 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.7 mtt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.867 0.365 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.62 168.27 11.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.178 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.21 -26.91 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.09 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -63.77 149.86 92.08 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.62 -90.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 122.37 2.047 . . . . 0.0 112.19 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -155.02 148.5 25.21 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.839 0.352 . . . . 0.0 111.168 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.12 -53.34 3.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.06 73.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.938 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.674 HG22 HG21 ' A' ' 133' ' ' THR . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.407 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.98 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.404 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.81 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' CB ' ' A' ' 74' ' ' ALA . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.532 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.667 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.406 HG22 ' HB3' ' A' ' 43' ' ' ASP . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.406 ' HB3' HG22 ' A' ' 39' ' ' ILE . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.599 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.449 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.701 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.811 ' HB2' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.705 ' OG ' HD11 ' A' ' 72' ' ' LEU . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.471 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.417 ' O ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.4 t-20 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 67' ' ' ASN . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.705 HD11 ' OG ' ' A' ' 60' ' ' SER . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.448 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' ' 56' ' ' PHE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.443 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.822 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.667 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.658 HG13 ' O ' ' A' ' 112' ' ' ILE . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.405 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.98 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.55 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.59 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.938 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.655 ' O ' HD13 ' A' ' 120' ' ' ILE . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.655 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.743 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.743 ' N ' HD23 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.664 HD22 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.671 ' SG ' HG22 ' A' ' 32' ' ' THR . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.81 ' HA ' HG23 ' A' ' 32' ' ' THR . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.431 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.664 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.644 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.773 0.321 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.87 12.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.991 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -84.01 -26.71 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.548 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.558 ' OD1' ' HB2' ' A' ' 7' ' ' ALA . 3.1 p30 -94.7 150.22 37.63 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.326 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -53.33 -90.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.386 2.058 . . . . 0.0 111.925 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 26.9 p -103.49 99.32 9.14 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.718 0.294 . . . . 0.0 111.283 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.558 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . . . -77.39 -83.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.587 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -29.47 70.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.452 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.575 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.867 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.489 HD12 ' CD1' ' A' ' 117' ' ' PHE . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' A' ' 20' ' ' LEU . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.967 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.654 HG22 ' ND2' ' A' ' 129' ' ' ASN . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.45 HD12 ' CB ' ' A' ' 74' ' ' ALA . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.543 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.784 HD21 HG11 ' A' ' 48' ' ' VAL . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.743 HG12 HG21 ' A' ' 48' ' ' VAL . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' CD ' ' O ' ' A' ' 120' ' ' ILE . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.418 HG23 HD22 ' A' ' 82' ' ' LEU . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.784 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.417 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.039 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.862 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.52 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.563 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.699 HD13 ' OD1' ' A' ' 67' ' ' ASN . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.53 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.6 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.408 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' OG ' ' A' ' 60' ' ' SER . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.688 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 1.039 HG23 HD12 ' A' ' 52' ' ' LEU . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.571 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.571 HD11 HG12 ' A' ' 48' ' ' VAL . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.501 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.427 HD21 ' HE3' ' A' ' 83' ' ' LYS . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.855 HG13 ' HB2' ' A' ' 93' ' ' LEU . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.413 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.855 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.804 HG22 ' HA ' ' A' ' 38' ' ' ILE . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.501 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.967 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.701 HG22 ' HG3' ' A' ' 107' ' ' GLU . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.701 ' HG3' HG22 ' A' ' 101' ' ' VAL . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.621 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.409 ' HG3' ' HB2' ' A' ' 89' ' ' PRO . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.481 ' CB ' HD11 ' A' ' 120' ' ' ILE . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.867 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.675 HG22 ' H ' ' A' ' 122' ' ' THR . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.675 ' H ' HG22 ' A' ' 120' ' ' ILE . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.656 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.656 ' N ' HD23 ' A' ' 124' ' ' LEU . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.634 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.654 ' ND2' HG22 ' A' ' 32' ' ' THR . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.488 ' HB2' HD21 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.041 HG22 HD12 ' A' ' 136' ' ' LEU . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.602 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.041 HD12 HG22 ' A' ' 133' ' ' THR . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.692 HD11 ' HD2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.66 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.476 ' HB1' ' OD2' ' A' ' 4' ' ' ASP . . . -70.93 135.96 48.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -86.06 -10.5 54.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.476 ' OD2' ' HB1' ' A' ' 2' ' ' ALA . 2.0 p30 -55.54 141.46 63.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.025 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.33 -38.83 93.5 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.463 2.109 . . . . 0.0 112.441 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.8 p -178.6 37.01 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.001 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.85 -81.97 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.232 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.15 -29.24 70.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.635 ' O ' HG22 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.448 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.678 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.699 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.699 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.884 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 99' ' ' THR . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.702 HG21 HG21 ' A' ' 78' ' ' VAL . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.516 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.714 HG12 HG21 ' A' ' 48' ' ' VAL . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HD2' ' HB2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.792 HG23 HD22 ' A' ' 82' ' ' LEU . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.714 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.805 ' HB2' HG21 ' A' ' 75' ' ' ILE . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.479 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.593 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.664 HD12 ' HA ' ' A' ' 68' ' ' ARG . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.469 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.82 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.664 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.593 HD11 ' OG ' ' A' ' 60' ' ' SER . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.609 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.702 HG21 HG21 ' A' ' 35' ' ' ILE . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.455 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 3.5 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.469 ' NH1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.792 HD22 HG23 ' A' ' 45' ' ' ILE . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.469 HD11 ' NH1' ' A' ' 81' ' ' ARG . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.82 HG13 ' HB2' ' A' ' 93' ' ' LEU . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.465 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.82 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 112' ' ' ILE . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.516 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.402 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 33' ' ' SER . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.581 HG23 ' HG3' ' A' ' 108' ' ' LYS . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.581 ' HG3' HG23 ' A' ' 102' ' ' THR . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.734 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.678 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HD3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.721 ' O ' HD13 ' A' ' 120' ' ' ILE . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.721 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.794 HD23 ' N ' ' A' ' 125' ' ' TYR . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.794 ' N ' HD23 ' A' ' 124' ' ' LEU . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.499 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.637 ' SG ' HG22 ' A' ' 32' ' ' THR . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.884 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.421 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.499 ' ND1' HD22 ' A' ' 126' ' ' LEU . 9.7 m80 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.885 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.577 ' HA ' HG22 ' A' ' 137' ' ' THR . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.885 HD12 HG22 ' A' ' 133' ' ' THR . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.577 HG22 ' HA ' ' A' ' 134' ' ' GLU . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.643 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptp . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.01 168.83 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.091 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.97 -17.71 39.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.115 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.494 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 10.0 t70 -54.13 144.76 37.78 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.648 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CG ' ' A' ' 4' ' ' ASP . 9.5 Cg_endo -49.14 -85.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.801 2.334 . . . . 0.0 112.109 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.411 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 78.0 p -96.93 120.06 36.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.863 0.364 . . . . 0.0 111.09 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.2 -82.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.956 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.54 -26.29 20.57 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.13 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.577 ' O ' HG22 ' A' ' 14' ' ' ILE . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.727 HD12 ' HZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.868 ' HD3' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.576 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.868 HD12 ' HD3' ' A' ' 16' ' ' LYS . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 17' ' ' ILE . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 21' ' ' ILE . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.415 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.617 HD12 ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.481 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.604 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.814 HG12 HG21 ' A' ' 48' ' ' VAL . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.754 HG23 HD22 ' A' ' 82' ' ' LEU . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.814 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.917 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.822 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.813 HD12 ' HA ' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.436 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.439 ' O ' HD13 ' A' ' 69' ' ' LEU . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.9 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.2 t-20 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 65' ' ' ARG . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.9 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.448 HD11 ' OG ' ' A' ' 60' ' ' SER . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.617 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.917 HG23 HD12 ' A' ' 52' ' ' LEU . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 74' ' ' ALA . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.481 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.754 HD22 HG23 ' A' ' 45' ' ' ILE . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.508 ' HE3' HD21 ' A' ' 84' ' ' LEU . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.508 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.604 HG22 ' HA ' ' A' ' 38' ' ' ILE . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 112' ' ' ILE . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.509 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.422 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.67 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.498 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.432 ' O ' HD13 ' A' ' 120' ' ' ILE . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.432 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.55 ' SG ' HG22 ' A' ' 32' ' ' THR . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.822 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.509 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.904 HG22 HD12 ' A' ' 136' ' ' LEU . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.904 HD12 HG22 ' A' ' 133' ' ' THR . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.13 168.3 2.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.018 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -109.79 -26.82 9.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 12.9 t70 -60.48 150.35 74.22 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.801 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.8 Cg_endo -80.77 -77.7 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.094 2.53 . . . . 0.0 112.295 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 p -156.21 150.48 25.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 111.225 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.28 -52.91 3.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.918 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 -28.26 69.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.613 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.403 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.711 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.53 HG22 ' CG ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.447 ' HE1' HG23 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.458 HD12 ' CB ' ' A' ' 74' ' ' ALA . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.692 HD21 HG11 ' A' ' 48' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.86 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.689 ' CD1' HG21 ' A' ' 48' ' ' VAL . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.6 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.443 ' HB3' HG22 ' A' ' 39' ' ' ILE . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.692 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.411 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.888 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.755 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.527 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.452 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.751 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t-20 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.816 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 68' ' ' ARG . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.428 HD11 ' OG ' ' A' ' 60' ' ' SER . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.888 HG23 ' CD1' ' A' ' 52' ' ' LEU . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.84 ' HB ' HD21 ' A' ' 52' ' ' LEU . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 52' ' ' LEU . 9.6 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.505 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 83' ' ' LYS . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.802 HG13 ' HB2' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.41 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.802 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.86 HG22 ' HA ' ' A' ' 38' ' ' ILE . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 112' ' ' ILE . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.503 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.583 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.435 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.68 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.459 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.445 ' HD3' HG23 ' A' ' 94' ' ' VAL . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.533 ' CE2' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 120' ' ' ILE . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 119' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.485 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.683 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.684 ' HD2' HD13 ' A' ' 37' ' ' LEU . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.53 ' CG ' HG22 ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.503 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.691 HG22 HD12 ' A' ' 136' ' ' LEU . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.691 HD12 HG22 ' A' ' 133' ' ' THR . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.594 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.5 168.38 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -88.49 8.43 28.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -69.64 149.98 96.81 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.719 0.295 . . . . 0.0 110.917 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.5 -6.4 18.88 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.596 2.197 . . . . 0.0 112.762 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.6 p 172.91 75.16 0.0 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.018 0.437 . . . . 0.0 110.941 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.02 -85.6 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.521 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.55 -27.48 68.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 14' ' ' ILE . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.783 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.931 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.783 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 112' ' ' ILE . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.415 HG13 ' N ' ' A' ' 22' ' ' LYS . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' N ' HG13 ' A' ' 21' ' ' ILE . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.813 HD22 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.571 ' C ' HG22 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.44 ' N ' HG22 ' A' ' 100' ' ' ILE . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.436 HG22 ' OD1' ' A' ' 129' ' ' ASN . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.427 ' CE ' HG23 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.661 HG23 ' HE1' ' A' ' 125' ' ' TYR . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.503 ' HB3' HD23 ' A' ' 126' ' ' LEU . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.651 ' C ' HD12 ' A' ' 38' ' ' ILE . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.682 HD13 HD22 ' A' ' 124' ' ' LEU . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.641 ' CD1' HG21 ' A' ' 48' ' ' VAL . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.593 ' O ' HG11 ' A' ' 88' ' ' VAL . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.538 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.622 HG21 ' O ' ' A' ' 85' ' ' TYR . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.485 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 1.003 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.857 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.8 HD13 ' OD1' ' A' ' 67' ' ' ASN . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.458 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.891 ' O ' HG23 ' A' ' 71' ' ' VAL . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.891 HG23 ' O ' ' A' ' 67' ' ' ASN . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.549 HD11 ' OG ' ' A' ' 60' ' ' SER . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 1.003 HG23 HD12 ' A' ' 52' ' ' LEU . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.6 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 79' ' ' GLN . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.622 ' O ' HG21 ' A' ' 45' ' ' ILE . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 93' ' ' LEU . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.571 HG22 ' C ' ' A' ' 28' ' ' ARG . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.794 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.479 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.931 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.699 ' O ' HD13 ' A' ' 120' ' ' ILE . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.699 HD13 ' O ' ' A' ' 119' ' ' PRO . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.776 ' C ' HD13 ' A' ' 126' ' ' LEU . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.436 ' OD1' HG22 ' A' ' 32' ' ' THR . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.813 ' CD2' HD22 ' A' ' 24' ' ' LEU . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.702 HG22 HD12 ' A' ' 136' ' ' LEU . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.794 HD11 ' HZ ' ' A' ' 114' ' ' PHE . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ptm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.838 0.351 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.93 168.31 12.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.091 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -89.62 8.35 31.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.231 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -83.61 150.13 58.97 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-O 120.714 0.292 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.45 -151.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.609 2.206 . . . . 0.0 111.695 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -141.87 139.96 32.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.811 0.339 . . . . 0.0 111.076 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.54 -56.78 2.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.58 -36.5 82.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.93 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.567 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.866 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' A' ' 24' ' ' LEU . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.885 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.406 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.473 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.443 HG23 ' HE1' ' A' ' 125' ' ' TYR . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.675 HD21 HG11 ' A' ' 48' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.629 ' HA ' HG22 ' A' ' 94' ' ' VAL . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.752 HG12 HG21 ' A' ' 48' ' ' VAL . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.591 ' O ' HG11 ' A' ' 88' ' ' VAL . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.424 ' HB3' HG22 ' A' ' 39' ' ' ILE . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.401 HG21 ' O ' ' A' ' 85' ' ' TYR . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.752 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.61 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 71' ' ' VAL . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.554 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.61 HD11 ' OG ' ' A' ' 60' ' ' SER . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 74' ' ' ALA . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.426 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.43 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.401 ' O ' HG21 ' A' ' 45' ' ' ILE . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.835 HG13 ' HB2' ' A' ' 93' ' ' LEU . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.457 ' CD ' HD23 ' A' ' 93' ' ' LEU . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.835 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 38' ' ' ILE . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 112' ' ' ILE . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.477 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.406 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.885 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' OD1' ' A' ' 30' ' ' ASN . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.423 ' HG3' HG22 ' A' ' 101' ' ' VAL . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.49 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.635 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.866 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.593 ' O ' HD13 ' A' ' 120' ' ' ILE . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.593 HD13 ' O ' ' A' ' 119' ' ' PRO . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.413 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.608 HD22 HD12 ' A' ' 126' ' ' LEU . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.443 ' HE1' HG23 ' A' ' 35' ' ' ILE . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.627 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.46 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.477 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.476 ' HB2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.04 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.657 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.04 HD12 HG22 ' A' ' 133' ' ' THR . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.657 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 168.92 12.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.91 2.74 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.282 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -86.85 150.14 49.69 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.623 0.249 . . . . 0.0 110.537 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.79 -84.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.508 2.138 . . . . 0.0 112.118 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 63.0 p -106.35 111.8 24.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.789 0.328 . . . . 0.0 111.034 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.35 -80.25 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.975 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.28 69.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.88 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.469 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.608 ' O ' HG22 ' A' ' 14' ' ' ILE . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' HD12 ' A' ' 17' ' ' ILE . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.904 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.744 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.893 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.566 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.494 HG22 ' CG ' ' A' ' 129' ' ' ASN . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' C ' ' A' ' 74' ' ' ALA . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.505 HD21 HG11 ' A' ' 48' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.82 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 HD12 ' A' ' 93' ' ' LEU . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.743 HD11 ' O ' ' A' ' 87' ' ' LYS . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.505 HG11 HD21 ' A' ' 37' ' ' LEU . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.45 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.95 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.806 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.61 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.525 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.704 HD13 ' OD1' ' A' ' 67' ' ' ASN . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 62' ' ' ILE . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.704 ' OD1' HD13 ' A' ' 62' ' ' ILE . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.632 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 59' ' ' ALA . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.525 HD11 ' OG ' ' A' ' 60' ' ' SER . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.95 HG23 HD12 ' A' ' 52' ' ' LEU . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.502 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.706 HD22 HG23 ' A' ' 45' ' ' ILE . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.601 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.445 ' HB2' HD13 ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.743 ' O ' HD11 ' A' ' 45' ' ' ILE . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.848 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.438 ' CD ' HD23 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.465 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.848 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.82 HG22 ' HA ' ' A' ' 38' ' ' ILE . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.566 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.626 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.449 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.564 ' CB ' HD11 ' A' ' 120' ' ' ILE . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.904 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' CB ' ' HD2' ' A' ' 119' ' ' PRO . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 118' ' ' LYS . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.666 HG22 ' H ' ' A' ' 122' ' ' THR . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.666 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.705 HD13 ' OE2' ' A' ' 134' ' ' GLU . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.64 ' N ' HD23 ' A' ' 124' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.642 ' O ' HD22 ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.494 ' CG ' HG22 ' A' ' 32' ' ' THR . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.893 ' CD2' HD22 ' A' ' 24' ' ' LEU . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.425 ' HB2' HD21 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.83 HG22 HD12 ' A' ' 136' ' ' LEU . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.705 ' OE2' HD13 ' A' ' 124' ' ' LEU . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.83 HD12 HG22 ' A' ' 133' ' ' THR . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.503 HG22 ' HG ' ' A' ' 141' ' ' SER . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.765 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.536 HD11 HG13 ' A' ' 14' ' ' ILE . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.503 ' HG ' HG22 ' A' ' 137' ' ' THR . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.777 0.322 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.37 168.32 20.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -88.49 -26.98 21.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -62.87 149.8 89.11 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.67 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.59 -78.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.355 2.037 . . . . 0.0 112.116 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -163.84 30.52 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.772 0.32 . . . . 0.0 111.335 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.64 -87.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.891 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.79 -26.07 67.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.659 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.672 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.813 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.426 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 17' ' ' ILE . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 131' ' ' PHE . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.003 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.739 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.409 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.526 HD12 ' CB ' ' A' ' 74' ' ' ALA . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.495 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.753 HD21 HG11 ' A' ' 48' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.657 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.827 HG12 HG21 ' A' ' 48' ' ' VAL . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.601 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.548 HG23 HD22 ' A' ' 82' ' ' LEU . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.629 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.827 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.509 ' HE1' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.764 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.636 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 68' ' ' ARG . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' 62' ' ' ILE . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.407 ' O ' HD13 ' A' ' 69' ' ' LEU . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.88 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.681 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 67' ' ' ASN . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.636 HD11 ' OG ' ' A' ' 60' ' ' SER . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.526 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.764 HG23 ' CD1' ' A' ' 52' ' ' LEU . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' ALA . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.577 ' OE1' HG22 ' A' ' 75' ' ' ILE . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.548 HD22 HG23 ' A' ' 45' ' ' ILE . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.701 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.818 HG13 ' HB2' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.416 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 38' ' ' ILE . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 ' O ' ' A' ' 112' ' ' ILE . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 1.003 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.487 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.497 ' HD3' HG23 ' A' ' 94' ' ' VAL . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.813 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.628 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.618 ' SG ' HG22 ' A' ' 32' ' ' THR . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.739 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.401 ' C ' ' HG3' ' A' ' 34' ' ' MET . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.589 ' CD2' HD22 ' A' ' 24' ' ' LEU . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.966 HG22 HD12 ' A' ' 136' ' ' LEU . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.578 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.966 HD12 HG22 ' A' ' 133' ' ' THR . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.485 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.916 0.389 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.76 168.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.137 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -93.89 -26.88 16.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.049 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.0 p-10 -66.82 144.24 98.46 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.832 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -63.14 -69.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.491 2.127 . . . . 0.0 112.205 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -161.98 145.42 12.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.058 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.17 -46.36 8.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.117 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.571 ' O ' HG22 ' A' ' 14' ' ' ILE . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.791 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.551 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.727 ' HA ' HD12 ' A' ' 24' ' ' LEU . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 21' ' ' ILE . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.857 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.892 HG22 ' OD1' ' A' ' 129' ' ' ASN . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.417 HD13 ' OH ' ' A' ' 125' ' ' TYR . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.492 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 48' ' ' VAL . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 124' ' ' LEU . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.59 HG12 HG21 ' A' ' 48' ' ' VAL . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.59 ' O ' HG11 ' A' ' 88' ' ' VAL . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.63 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.59 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.443 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.871 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.8 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.402 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.523 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.831 HD12 ' HA ' ' A' ' 68' ' ' ARG . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.556 ' H ' HG22 ' A' ' 62' ' ' ILE . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.852 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.831 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.407 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 67' ' ' ASN . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.523 HD11 ' OG ' ' A' ' 60' ' ' SER . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.871 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 52' ' ' LEU . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.412 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.436 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.746 HD23 ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 93' ' ' LEU . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CD ' HD23 ' A' ' 93' ' ' LEU . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.836 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.857 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.418 HG21 ' OD1' ' A' ' 30' ' ' ASN . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.401 HG21 ' HE2' ' A' ' 108' ' ' LYS . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HE2' HG21 ' A' ' 102' ' ' THR . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.403 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.586 ' HG3' HG23 ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.436 ' O ' HD13 ' A' ' 120' ' ' ILE . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.512 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 38' ' ' ILE . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.704 ' N ' HD23 ' A' ' 124' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.439 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.892 ' OD1' HG22 ' A' ' 32' ' ' THR . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.439 ' ND1' HD22 ' A' ' 126' ' ' LEU . 10.2 m80 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.957 HG22 HD12 ' A' ' 136' ' ' LEU . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.957 HD12 HG22 ' A' ' 133' ' ' THR . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.834 0.349 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.71 168.22 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.191 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -102.3 -26.79 13.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.095 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -59.09 144.48 82.66 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.876 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.58 -67.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.468 2.112 . . . . 0.0 112.293 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.1 p -151.86 148.72 28.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.072 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.67 -51.94 3.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.004 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.52 69.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.194 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 14' ' ' ILE . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.701 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.832 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.431 HG23 ' O ' ' A' ' 17' ' ' ILE . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.639 HG22 ' CG ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.403 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.655 HD12 ' CB ' ' A' ' 74' ' ' ALA . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.68 HD21 ' CG1' ' A' ' 48' ' ' VAL . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.679 HG23 ' CG2' ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.742 ' CD1' HG21 ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.496 HG21 ' O ' ' A' ' 85' ' ' TYR . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.457 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.742 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.981 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.837 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.836 HD12 ' HA ' ' A' ' 68' ' ' ARG . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.564 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.451 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.836 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.732 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.981 HG23 HD12 ' A' ' 52' ' ' LEU . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 74' ' ' ALA . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.605 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.676 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.676 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.496 ' O ' HG21 ' A' ' 45' ' ' ILE . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.679 ' CG2' HG23 ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.683 HG23 HD11 ' A' ' 93' ' ' LEU . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.669 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.526 HG21 ' NZ ' ' A' ' 108' ' ' LYS . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.526 ' NZ ' HG21 ' A' ' 102' ' ' THR . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.4 ' HB2' ' NH1' ' A' ' 81' ' ' ARG . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.618 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.443 ' HG3' HG23 ' A' ' 94' ' ' VAL . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.832 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.53 ' O ' HD13 ' A' ' 120' ' ' ILE . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.53 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.664 HD22 HD12 ' A' ' 126' ' ' LEU . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.496 ' N ' HD23 ' A' ' 124' ' ' LEU . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.639 ' CG ' HG22 ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.488 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.619 HG22 HD12 ' A' ' 136' ' ' LEU . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.644 ' O ' HD22 ' A' ' 139' ' ' LEU . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.4 mmm . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 168.37 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.17 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.31 -26.8 28.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.051 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -58.47 146.61 72.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.699 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -55.18 -74.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.328 2.019 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.7 p -163.06 140.49 7.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.87 0.367 . . . . 0.0 111.153 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.16 -39.79 10.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.953 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.18 71.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 14' ' ' ILE . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.549 ' O ' HD12 ' A' ' 17' ' ' ILE . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.774 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 17' ' ' ILE . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.466 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.955 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.772 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' MET . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.496 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.62 HG21 HG21 ' A' ' 78' ' ' VAL . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.74 HD21 HG11 ' A' ' 48' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.641 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.775 HG12 HG21 ' A' ' 48' ' ' VAL . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.568 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.601 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.775 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.455 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.948 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.625 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 68' ' ' ARG . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.573 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.892 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.571 HD21 ' NH2' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 67' ' ' ASN . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.625 HD11 ' OG ' ' A' ' 60' ' ' SER . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.948 HG23 HD12 ' A' ' 52' ' ' LEU . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 HG21 ' A' ' 35' ' ' ILE . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.839 HG13 ' HB2' ' A' ' 93' ' ' LEU . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.839 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 38' ' ' ILE . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.955 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.42 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.774 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.706 ' O ' HD13 ' A' ' 120' ' ' ILE . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.706 HD13 ' O ' ' A' ' 119' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.595 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.595 ' N ' HD23 ' A' ' 124' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.63 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.581 ' SG ' HG22 ' A' ' 32' ' ' THR . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' THR . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.416 ' C ' ' HG3' ' A' ' 34' ' ' MET . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.496 ' CZ ' ' HE2' ' A' ' 34' ' ' MET . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.486 ' HB2' HD21 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.671 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.605 ' HB2' ' OE2' ' A' ' 134' ' ' GLU . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 3.4 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.091 0.472 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.523 ' N ' ' HG3' ' A' ' 1' ' ' MET . . . -87.91 168.33 12.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.472 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -84.27 -26.87 28.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.863 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -115.33 149.95 43.66 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.29 -95.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.351 2.034 . . . . 0.0 112.043 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 p -155.33 150.13 26.5 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.914 0.387 . . . . 0.0 111.297 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.7 -53.24 3.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.862 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.52 -29.0 70.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.839 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.721 ' O ' HG22 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.895 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.458 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.717 ' HA ' HD12 ' A' ' 24' ' ' LEU . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.659 ' N ' HD12 ' A' ' 21' ' ' ILE . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.013 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.4 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.629 HD12 ' CB ' ' A' ' 74' ' ' ALA . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD22 HG11 ' A' ' 78' ' ' VAL . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.601 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.587 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.453 HG23 HD22 ' A' ' 82' ' ' LEU . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.487 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.758 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.877 ' HB2' HG21 ' A' ' 75' ' ' ILE . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.658 HD12 ' HA ' ' A' ' 68' ' ' ARG . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 69' ' ' LEU . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.819 ' O ' HG23 ' A' ' 71' ' ' VAL . 8.8 t-20 -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.658 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.617 HD22 ' HG2' ' A' ' 68' ' ' ARG . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 67' ' ' ASN . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.629 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.877 HG21 ' HB2' ' A' ' 56' ' ' PHE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.453 HD22 HG23 ' A' ' 45' ' ' ILE . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.843 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.412 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.843 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.601 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.523 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 1.013 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.65 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.433 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.601 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.477 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.895 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.675 ' O ' HD13 ' A' ' 120' ' ' ILE . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 119' ' ' PRO . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.449 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.616 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.616 ' N ' HD23 ' A' ' 124' ' ' LEU . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.435 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.036 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.036 HD12 HG22 ' A' ' 133' ' ' THR . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.412 ' HA ' HD13 ' A' ' 140' ' ' LEU . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.805 0.336 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.95 165.38 15.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.135 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -84.46 -24.02 29.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.851 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' PRO . 7.9 m-20 -55.27 150.31 22.83 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.41 ' O ' ' O ' ' A' ' 4' ' ' ASP . 48.4 Cg_exo -56.06 -143.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 122.86 2.374 . . . . 0.0 112.453 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.401 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 25.8 p -92.89 89.15 6.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.805 0.336 . . . . 0.0 110.935 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.87 -82.93 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.921 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -25.64 68.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.666 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.711 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.486 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.421 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.84 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.439 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 21' ' ' ILE . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 33' ' ' SER . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.821 HG23 ' HA ' ' A' ' 128' ' ' ASP . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.48 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.58 HD12 ' CB ' ' A' ' 74' ' ' ALA . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.653 HD21 HG11 ' A' ' 48' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.67 HG12 HG21 ' A' ' 48' ' ' VAL . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.806 HG23 HD22 ' A' ' 82' ' ' LEU . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.621 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.67 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.438 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.455 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 68' ' ' ARG . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.586 ' H ' HG22 ' A' ' 62' ' ' ILE . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.874 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.796 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.429 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.455 HD21 ' OG ' ' A' ' 60' ' ' SER . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.58 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG21 ' A' ' 35' ' ' ILE . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.482 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.806 HD22 HG23 ' A' ' 45' ' ' ILE . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.847 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.847 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.761 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.677 HG22 ' CB ' ' A' ' 113' ' ' ASP . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.49 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.677 ' CB ' HG22 ' A' ' 95' ' ' VAL . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.483 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.489 ' CB ' HD11 ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.71 HG22 ' H ' ' A' ' 122' ' ' THR . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.71 ' H ' HG22 ' A' ' 120' ' ' ILE . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.4 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.614 HD22 HD12 ' A' ' 126' ' ' LEU . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.607 ' N ' HD23 ' A' ' 124' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.625 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' HG22 ' A' ' 32' ' ' THR . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.821 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.424 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' THR . . . . . 0.796 HG22 HD12 ' A' ' 136' ' ' LEU . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.796 HD12 HG22 ' A' ' 133' ' ' THR . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.566 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 140' ' ' LEU . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.79 0.329 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.77 168.11 0.98 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.198 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -88.18 -26.65 22.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.068 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.59 150.01 37.58 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.46 ' HB2' ' H ' ' A' ' 6' ' ' SER . 84.2 Cg_exo -48.59 -108.05 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.973 2.448 . . . . 0.0 112.602 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.46 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 67.3 p -144.49 146.36 32.37 Favored 'General case' 0 C--O 1.231 0.095 0 O-C-N 121.993 -0.442 . . . . 0.0 110.914 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.32 -52.89 3.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.004 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.7 -34.4 78.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 14' ' ' ILE . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 17' ' ' ILE . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.922 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.579 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.595 HG22 ' CG ' ' A' ' 129' ' ' ASN . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.484 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.727 HG23 ' HE1' ' A' ' 125' ' ' TYR . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD21 HG11 ' A' ' 48' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.668 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 93' ' ' LEU . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.4 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.608 HG21 HG12 ' A' ' 39' ' ' ILE . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.436 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.898 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.476 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.457 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.597 ' OD1' HD13 ' A' ' 62' ' ' ILE . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.786 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ASN . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.898 HG23 HD12 ' A' ' 52' ' ' LEU . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.605 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.605 HD23 ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.405 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.829 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.626 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 94' ' ' VAL . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.922 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.423 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.545 ' C ' HD23 ' A' ' 124' ' ' LEU . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.727 ' HE1' HG23 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' ND1' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASN . . . . . 0.595 ' CG ' HG22 ' A' ' 32' ' ' THR . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PHE . . . . . 0.529 ' CD2' HD22 ' A' ' 24' ' ' LEU . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' HIS . . . . . 0.609 ' ND1' HD22 ' A' ' 126' ' ' LEU . 63.9 m80 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' THR . . . . . 1.052 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.66 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 1.052 HD12 HG22 ' A' ' 133' ' ' THR . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.532 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.569 HD21 HD11 ' A' ' 14' ' ' ILE . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.592 ' O ' HG22 ' A' ' 14' ' ' ILE . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.926 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CH2' ' HD2' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HD2' ' CH2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.627 ' HA ' HD12 ' A' ' 24' ' ' LEU . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 21' ' ' ILE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.027 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.459 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.656 ' O ' HG23 ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.656 HG23 ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.459 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.719 HG21 HG21 ' A' ' 78' ' ' VAL . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.468 ' HB2' HD23 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 38' ' ' ILE . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.77 HD12 ' C ' ' A' ' 37' ' ' LEU . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.739 HG12 HG21 ' A' ' 48' ' ' VAL . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.582 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.459 HG23 HD22 ' A' ' 82' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.739 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.835 HD21 ' HB ' ' A' ' 78' ' ' VAL . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.768 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.708 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 62' ' ' ILE . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.881 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.708 ' HA ' HD12 ' A' ' 62' ' ' ILE . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 60' ' ' SER . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.487 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.811 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.835 ' HB ' HD21 ' A' ' 52' ' ' LEU . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.459 HD22 HG23 ' A' ' 45' ' ' ILE . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HG2' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.5 HD22 ' HG2' ' A' ' 83' ' ' LYS . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.833 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.405 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.833 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 38' ' ' ILE . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.667 HG13 ' O ' ' A' ' 112' ' ' ILE . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.419 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 1.027 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.667 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.454 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.405 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.4 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.926 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.579 ' O ' HD13 ' A' ' 120' ' ' ILE . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.579 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.41 ' HB3' ' HD3' ' A' ' 40' ' ' PRO . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.81 ' CD2' HD11 ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.702 ' C ' HD13 ' A' ' 126' ' ' LEU . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.81 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 32' ' ' THR . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.74 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.686 ' HA ' HG22 ' A' ' 137' ' ' THR . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 133' ' ' THR . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 134' ' ' GLU . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.63 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.815 0.341 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 14' ' ' ILE . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.734 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.616 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.616 HG23 ' O ' ' A' ' 17' ' ' ILE . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 131' ' ' PHE . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.905 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.588 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.688 HG23 ' HE1' ' A' ' 125' ' ' TYR . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.522 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD21 HG11 ' A' ' 48' ' ' VAL . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.743 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.592 HG12 HG21 ' A' ' 48' ' ' VAL . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.851 HG23 HD22 ' A' ' 82' ' ' LEU . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.592 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.429 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.9 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.596 ' H ' HG22 ' A' ' 62' ' ' ILE . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.906 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.5 OUTLIER -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.893 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.643 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.713 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.9 HG23 ' CD1' ' A' ' 52' ' ' LEU . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.713 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.3 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.455 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.851 HD22 HG23 ' A' ' 45' ' ' ILE . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.474 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.811 HG13 ' HB2' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.406 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.811 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.743 HG22 ' HA ' ' A' ' 38' ' ' ILE . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.643 HG13 ' O ' ' A' ' 112' ' ' ILE . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.531 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.588 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.905 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.643 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.734 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.506 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.676 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.696 ' CE2' HD22 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.866 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.414 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.408 ' N ' HG22 ' A' ' 32' ' ' THR . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.866 ' CD2' HD22 ' A' ' 126' ' ' LEU . 80.9 m-70 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.843 HG22 HD12 ' A' ' 136' ' ' LEU . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.843 HD12 HG22 ' A' ' 133' ' ' THR . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.638 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.64 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.781 0.324 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.508 ' O ' HG22 ' A' ' 14' ' ' ILE . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.508 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.413 ' CZ2' ' HE3' ' A' ' 19' ' ' LYS . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 21' ' ' ILE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 17' ' ' ILE . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.547 HD22 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.581 HG22 ' ND2' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.606 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.401 HD12 ' CB ' ' A' ' 74' ' ' ALA . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.477 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.714 HD21 HG11 ' A' ' 48' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.852 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.567 HG12 HG21 ' A' ' 48' ' ' VAL . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.466 ' HB3' HG22 ' A' ' 39' ' ' ILE . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.81 HG23 HD22 ' A' ' 82' ' ' LEU . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.714 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.405 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.955 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.781 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.627 ' H ' HG22 ' A' ' 62' ' ' ILE . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.737 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.476 HD21 ' NH2' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.647 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.955 HG23 HD12 ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.647 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.81 HD22 HG23 ' A' ' 45' ' ' ILE . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.819 HG13 ' HB2' ' A' ' 93' ' ' LEU . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.414 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.819 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.852 HG22 ' HA ' ' A' ' 38' ' ' ILE . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.499 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.606 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.655 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.414 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 1.023 ' HB3' HD21 ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.537 ' HB2' HD13 ' A' ' 139' ' ' LEU . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.652 ' N ' HD23 ' A' ' 124' ' ' LEU . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 34' ' ' MET . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.581 ' ND2' HG22 ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.547 ' CD2' HD22 ' A' ' 24' ' ' LEU . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.962 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.962 HD12 HG22 ' A' ' 133' ' ' THR . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 1.023 HD21 ' HB3' ' A' ' 117' ' ' PHE . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.579 ' O ' HD12 ' A' ' 17' ' ' ILE . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.759 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.418 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.579 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.802 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.685 HG22 ' OD1' ' A' ' 129' ' ' ASN . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.402 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.406 ' CD1' ' HB3' ' A' ' 74' ' ' ALA . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.485 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.772 HD21 HG11 ' A' ' 48' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.761 HD13 HD22 ' A' ' 124' ' ' LEU . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.694 HG12 HG21 ' A' ' 48' ' ' VAL . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.578 ' O ' HG11 ' A' ' 88' ' ' VAL . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.772 HG11 HD21 ' A' ' 37' ' ' LEU . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.068 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.807 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.581 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.646 ' CD1' HG21 ' A' ' 71' ' ' VAL . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.525 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.774 ' O ' HG23 ' A' ' 71' ' ' VAL . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 67' ' ' ASN . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.581 HD11 ' OG ' ' A' ' 60' ' ' SER . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.687 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 1.068 HG23 HD12 ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.717 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.717 HD23 ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.814 HG13 ' HB2' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.814 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.569 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 112' ' ' ILE . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.802 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.679 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.531 ' CB ' HG22 ' A' ' 95' ' ' VAL . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.433 ' O ' HD13 ' A' ' 120' ' ' ILE . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.516 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.827 ' CD2' HD11 ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.788 ' C ' HD13 ' A' ' 126' ' ' LEU . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.827 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' MET . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.685 ' OD1' HG22 ' A' ' 32' ' ' THR . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.467 ' CB ' ' HG1' ' A' ' 137' ' ' THR . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.798 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.6 ' O ' HD22 ' A' ' 139' ' ' LEU . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' A' ' 133' ' ' THR . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.556 HD11 HG13 ' A' ' 14' ' ' ILE . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.596 ' O ' HG22 ' A' ' 14' ' ' ILE . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.968 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.417 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.551 HD13 ' HD1' ' A' ' 117' ' ' PHE . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.45 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.774 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 99' ' ' THR . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.644 HD12 ' CB ' ' A' ' 74' ' ' ALA . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.651 HG23 ' CG2' ' A' ' 94' ' ' VAL . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' HB3' ' A' ' 43' ' ' ASP . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.603 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB3' HG22 ' A' ' 39' ' ' ILE . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.641 HG23 HD22 ' A' ' 82' ' ' LEU . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.464 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.719 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.82 ' HB2' HG21 ' A' ' 75' ' ' ILE . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.519 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.591 ' OG ' HD11 ' A' ' 72' ' ' LEU . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 68' ' ' ARG . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 69' ' ' LEU . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.728 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.591 HD11 ' OG ' ' A' ' 60' ' ' SER . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.644 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.82 HG21 ' HB2' ' A' ' 56' ' ' PHE . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mm-40 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.641 HD22 HG23 ' A' ' 45' ' ' ILE . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.493 ' HG2' HD23 ' A' ' 84' ' ' LEU . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.493 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.457 ' O ' HD12 ' A' ' 45' ' ' ILE . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.605 ' O ' HD11 ' A' ' 45' ' ' ILE . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.803 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.424 ' CD ' HD23 ' A' ' 93' ' ' LEU . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.421 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.803 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.651 ' CG2' HG23 ' A' ' 38' ' ' ILE . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.446 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 33' ' ' SER . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.521 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.968 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.471 ' O ' HD13 ' A' ' 120' ' ' ILE . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.674 ' C ' HD13 ' A' ' 126' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.557 ' SG ' HG22 ' A' ' 32' ' ' THR . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.774 ' HA ' HG23 ' A' ' 32' ' ' THR . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.444 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.465 ' HB2' HD21 ' A' ' 126' ' ' LEU . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.882 HG22 HD12 ' A' ' 136' ' ' LEU . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.574 ' HB3' ' CD1' ' A' ' 38' ' ' ILE . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.882 HD12 HG22 ' A' ' 133' ' ' THR . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.77 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.827 0.346 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.938 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.674 HG22 HG21 ' A' ' 133' ' ' THR . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.407 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.98 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.404 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.81 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' CB ' ' A' ' 74' ' ' ALA . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.532 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.667 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.406 HG22 ' HB3' ' A' ' 43' ' ' ASP . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.406 ' HB3' HG22 ' A' ' 39' ' ' ILE . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.599 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.449 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.701 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.811 ' HB2' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.705 ' OG ' HD11 ' A' ' 72' ' ' LEU . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.471 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.417 ' O ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 71' ' ' VAL . 15.6 t30 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 67' ' ' ASN . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.705 HD11 ' OG ' ' A' ' 60' ' ' SER . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.448 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' ' 56' ' ' PHE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.443 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.822 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.667 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.658 HG13 ' O ' ' A' ' 112' ' ' ILE . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.405 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.98 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.55 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.59 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.938 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.655 ' O ' HD13 ' A' ' 120' ' ' ILE . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.655 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.743 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.743 ' N ' HD23 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.664 HD22 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.671 ' SG ' HG22 ' A' ' 32' ' ' THR . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.81 ' HA ' HG23 ' A' ' 32' ' ' THR . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.431 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.664 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.644 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.575 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.867 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.489 HD12 ' CD1' ' A' ' 117' ' ' PHE . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' A' ' 20' ' ' LEU . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.967 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.654 HG22 ' ND2' ' A' ' 129' ' ' ASN . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.45 HD12 ' CB ' ' A' ' 74' ' ' ALA . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.543 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.784 HD21 HG11 ' A' ' 48' ' ' VAL . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.743 HG12 HG21 ' A' ' 48' ' ' VAL . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' CD ' ' O ' ' A' ' 120' ' ' ILE . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.418 HG23 HD22 ' A' ' 82' ' ' LEU . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.784 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.417 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.039 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.862 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.52 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.563 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.699 HD13 ' OD1' ' A' ' 67' ' ' ASN . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.53 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.6 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.408 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' OG ' ' A' ' 60' ' ' SER . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.688 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 1.039 HG23 HD12 ' A' ' 52' ' ' LEU . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.571 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.571 HD11 HG12 ' A' ' 48' ' ' VAL . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.501 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.427 HD21 ' HE3' ' A' ' 83' ' ' LYS . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.855 HG13 ' HB2' ' A' ' 93' ' ' LEU . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.413 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.855 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.804 HG22 ' HA ' ' A' ' 38' ' ' ILE . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.501 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.967 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.701 HG22 ' HG3' ' A' ' 107' ' ' GLU . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.701 ' HG3' HG22 ' A' ' 101' ' ' VAL . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.621 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.409 ' HG3' ' HB2' ' A' ' 89' ' ' PRO . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.481 ' CB ' HD11 ' A' ' 120' ' ' ILE . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.867 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.675 HG22 ' H ' ' A' ' 122' ' ' THR . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.675 ' H ' HG22 ' A' ' 120' ' ' ILE . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.656 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.656 ' N ' HD23 ' A' ' 124' ' ' LEU . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.634 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.654 ' ND2' HG22 ' A' ' 32' ' ' THR . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.488 ' HB2' HD21 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.041 HG22 HD12 ' A' ' 136' ' ' LEU . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.602 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.041 HD12 HG22 ' A' ' 133' ' ' THR . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.692 HD11 ' HD2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.66 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.635 ' O ' HG22 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.448 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.678 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.699 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.699 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.884 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 99' ' ' THR . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.702 HG21 HG21 ' A' ' 78' ' ' VAL . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.516 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.714 HG12 HG21 ' A' ' 48' ' ' VAL . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HD2' ' HB2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.792 HG23 HD22 ' A' ' 82' ' ' LEU . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.714 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.805 ' HB2' HG21 ' A' ' 75' ' ' ILE . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.479 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.593 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.664 HD12 ' HA ' ' A' ' 68' ' ' ARG . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.469 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.82 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.664 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.593 HD11 ' OG ' ' A' ' 60' ' ' SER . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.609 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.702 HG21 HG21 ' A' ' 35' ' ' ILE . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.455 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 4.6 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.469 ' NH1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.792 HD22 HG23 ' A' ' 45' ' ' ILE . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.469 HD11 ' NH1' ' A' ' 81' ' ' ARG . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.82 HG13 ' HB2' ' A' ' 93' ' ' LEU . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.465 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.82 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 112' ' ' ILE . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.516 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.402 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 33' ' ' SER . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.581 HG23 ' HG3' ' A' ' 108' ' ' LYS . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.581 ' HG3' HG23 ' A' ' 102' ' ' THR . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.734 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.678 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HD3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.721 ' O ' HD13 ' A' ' 120' ' ' ILE . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.721 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.794 HD23 ' N ' ' A' ' 125' ' ' TYR . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.794 ' N ' HD23 ' A' ' 124' ' ' LEU . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.637 ' SG ' HG22 ' A' ' 32' ' ' THR . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.884 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.421 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.699 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.4 m-70 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.885 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.577 ' HA ' HG22 ' A' ' 137' ' ' THR . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.885 HD12 HG22 ' A' ' 133' ' ' THR . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.577 HG22 ' HA ' ' A' ' 134' ' ' GLU . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.643 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.721 0.296 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.577 ' O ' HG22 ' A' ' 14' ' ' ILE . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.727 HD12 ' HZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.868 ' HD3' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.576 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.868 HD12 ' HD3' ' A' ' 16' ' ' LYS . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 17' ' ' ILE . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 21' ' ' ILE . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.415 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.617 HD12 ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.481 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.604 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.814 HG12 HG21 ' A' ' 48' ' ' VAL . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.754 HG23 HD22 ' A' ' 82' ' ' LEU . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.814 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.917 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.822 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.813 HD12 ' HA ' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.436 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.439 ' O ' HD13 ' A' ' 69' ' ' LEU . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.9 ' O ' HG23 ' A' ' 71' ' ' VAL . 6.7 t30 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 65' ' ' ARG . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.9 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.448 HD11 ' OG ' ' A' ' 60' ' ' SER . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.617 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.917 HG23 HD12 ' A' ' 52' ' ' LEU . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.401 ' HG ' ' HZ3' ' A' ' 109' ' ' LYS . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 74' ' ' ALA . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.481 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.754 HD22 HG23 ' A' ' 45' ' ' ILE . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.508 ' HE3' HD21 ' A' ' 84' ' ' LEU . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.508 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.604 HG22 ' HA ' ' A' ' 38' ' ' ILE . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 112' ' ' ILE . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.509 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.422 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.439 ' HZ1' ' HA ' ' A' ' 74' ' ' ALA . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.67 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.498 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.432 ' O ' HD13 ' A' ' 120' ' ' ILE . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.432 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.55 ' SG ' HG22 ' A' ' 32' ' ' THR . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.822 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.509 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.904 HG22 HD12 ' A' ' 136' ' ' LEU . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.904 HD12 HG22 ' A' ' 133' ' ' THR . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.613 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.403 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.711 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.53 HG22 ' CG ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.447 ' HE1' HG23 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.458 HD12 ' CB ' ' A' ' 74' ' ' ALA . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.692 HD21 HG11 ' A' ' 48' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.86 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.689 ' CD1' HG21 ' A' ' 48' ' ' VAL . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.6 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.443 ' HB3' HG22 ' A' ' 39' ' ' ILE . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.692 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.411 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.888 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.755 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.527 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.452 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.784 HD22 HD13 ' A' ' 62' ' ' ILE . 5.4 t30 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.816 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 68' ' ' ARG . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.428 HD11 ' OG ' ' A' ' 60' ' ' SER . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.888 HG23 ' CD1' ' A' ' 52' ' ' LEU . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.84 ' HB ' HD21 ' A' ' 52' ' ' LEU . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 52' ' ' LEU . 4.0 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.5 mm-40 -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.505 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 83' ' ' LYS . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.802 HG13 ' HB2' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.41 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.802 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.86 HG22 ' HA ' ' A' ' 38' ' ' ILE . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 112' ' ' ILE . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.503 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.583 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.435 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.68 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.459 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.445 ' HD3' HG23 ' A' ' 94' ' ' VAL . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.533 ' CE2' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 120' ' ' ILE . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 119' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.485 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.683 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.684 ' HD2' HD13 ' A' ' 37' ' ' LEU . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.53 ' CG ' HG22 ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.503 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.691 HG22 HD12 ' A' ' 136' ' ' LEU . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.691 HD12 HG22 ' A' ' 133' ' ' THR . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.594 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 14' ' ' ILE . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.783 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.931 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.783 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 112' ' ' ILE . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.415 HG13 ' N ' ' A' ' 22' ' ' LYS . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' N ' HG13 ' A' ' 21' ' ' ILE . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.813 HD22 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.571 ' C ' HG22 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.44 ' N ' HG22 ' A' ' 100' ' ' ILE . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.436 HG22 ' OD1' ' A' ' 129' ' ' ASN . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.427 ' CE ' HG23 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.661 HG23 ' HE1' ' A' ' 125' ' ' TYR . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.503 ' HB3' HD23 ' A' ' 126' ' ' LEU . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.651 ' C ' HD12 ' A' ' 38' ' ' ILE . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.682 HD13 HD22 ' A' ' 124' ' ' LEU . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.641 ' CD1' HG21 ' A' ' 48' ' ' VAL . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.593 ' O ' HG11 ' A' ' 88' ' ' VAL . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.538 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.622 HG21 ' O ' ' A' ' 85' ' ' TYR . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.485 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 1.003 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.857 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.8 HD13 ' OD1' ' A' ' 67' ' ' ASN . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.458 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.891 ' O ' HG23 ' A' ' 71' ' ' VAL . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.891 HG23 ' O ' ' A' ' 67' ' ' ASN . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.549 HD11 ' OG ' ' A' ' 60' ' ' SER . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 1.003 HG23 HD12 ' A' ' 52' ' ' LEU . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.3 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 79' ' ' GLN . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.622 ' O ' HG21 ' A' ' 45' ' ' ILE . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 93' ' ' LEU . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.571 HG22 ' C ' ' A' ' 28' ' ' ARG . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.794 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.479 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.931 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.699 ' O ' HD13 ' A' ' 120' ' ' ILE . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.699 HD13 ' O ' ' A' ' 119' ' ' PRO . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.776 ' C ' HD13 ' A' ' 126' ' ' LEU . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.436 ' OD1' HG22 ' A' ' 32' ' ' THR . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.813 ' CD2' HD22 ' A' ' 24' ' ' LEU . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.702 HG22 HD12 ' A' ' 136' ' ' LEU . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.794 HD11 ' HZ ' ' A' ' 114' ' ' PHE . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.567 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.866 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' A' ' 24' ' ' LEU . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.885 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.406 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.473 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.443 HG23 ' HE1' ' A' ' 125' ' ' TYR . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.675 HD21 HG11 ' A' ' 48' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.629 ' HA ' HG22 ' A' ' 94' ' ' VAL . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.752 HG12 HG21 ' A' ' 48' ' ' VAL . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.591 ' O ' HG11 ' A' ' 88' ' ' VAL . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.424 ' HB3' HG22 ' A' ' 39' ' ' ILE . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.401 HG21 ' O ' ' A' ' 85' ' ' TYR . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.752 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.61 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 71' ' ' VAL . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.554 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.61 HD11 ' OG ' ' A' ' 60' ' ' SER . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 74' ' ' ALA . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.426 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.43 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.401 ' O ' HG21 ' A' ' 45' ' ' ILE . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.835 HG13 ' HB2' ' A' ' 93' ' ' LEU . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.457 ' CD ' HD23 ' A' ' 93' ' ' LEU . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.835 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 38' ' ' ILE . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 112' ' ' ILE . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.477 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.406 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.885 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' OD1' ' A' ' 30' ' ' ASN . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.423 ' HG3' HG22 ' A' ' 101' ' ' VAL . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.49 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.635 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.866 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.593 ' O ' HD13 ' A' ' 120' ' ' ILE . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.593 HD13 ' O ' ' A' ' 119' ' ' PRO . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.413 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.608 HD22 HD12 ' A' ' 126' ' ' LEU . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.443 ' HE1' HG23 ' A' ' 35' ' ' ILE . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.627 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.46 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.477 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.476 ' HB2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.04 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.657 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.04 HD12 HG22 ' A' ' 133' ' ' THR . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.657 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.767 0.318 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.608 ' O ' HG22 ' A' ' 14' ' ' ILE . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' HD12 ' A' ' 17' ' ' ILE . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.904 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.744 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.893 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.566 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.494 HG22 ' CG ' ' A' ' 129' ' ' ASN . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' C ' ' A' ' 74' ' ' ALA . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.505 HD21 HG11 ' A' ' 48' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.82 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 HD12 ' A' ' 93' ' ' LEU . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.743 HD11 ' O ' ' A' ' 87' ' ' LYS . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.505 HG11 HD21 ' A' ' 37' ' ' LEU . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.45 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.95 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.806 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.61 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.525 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.704 HD13 ' OD1' ' A' ' 67' ' ' ASN . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 62' ' ' ILE . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.704 ' OD1' HD13 ' A' ' 62' ' ' ILE . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.632 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 59' ' ' ALA . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.525 HD11 ' OG ' ' A' ' 60' ' ' SER . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.95 HG23 HD12 ' A' ' 52' ' ' LEU . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.502 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.706 HD22 HG23 ' A' ' 45' ' ' ILE . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.601 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.445 ' HB2' HD13 ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.743 ' O ' HD11 ' A' ' 45' ' ' ILE . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.848 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.438 ' CD ' HD23 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.465 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.848 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.82 HG22 ' HA ' ' A' ' 38' ' ' ILE . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.566 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.626 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.449 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.564 ' CB ' HD11 ' A' ' 120' ' ' ILE . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.904 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' CB ' ' HD2' ' A' ' 119' ' ' PRO . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 118' ' ' LYS . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.666 HG22 ' H ' ' A' ' 122' ' ' THR . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.666 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.705 HD13 ' OE2' ' A' ' 134' ' ' GLU . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.64 ' N ' HD23 ' A' ' 124' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.642 ' O ' HD22 ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.494 ' CG ' HG22 ' A' ' 32' ' ' THR . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.893 ' CD2' HD22 ' A' ' 24' ' ' LEU . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.425 ' HB2' HD21 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.83 HG22 HD12 ' A' ' 136' ' ' LEU . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.705 ' OE2' HD13 ' A' ' 124' ' ' LEU . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.83 HD12 HG22 ' A' ' 133' ' ' THR . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.503 HG22 ' HG ' ' A' ' 141' ' ' SER . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.765 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.536 HD11 HG13 ' A' ' 14' ' ' ILE . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . 0.503 ' HG ' HG22 ' A' ' 137' ' ' THR . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.659 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.672 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.813 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.426 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 17' ' ' ILE . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 131' ' ' PHE . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.003 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.739 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.409 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.526 HD12 ' CB ' ' A' ' 74' ' ' ALA . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.495 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.753 HD21 HG11 ' A' ' 48' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.657 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.827 HG12 HG21 ' A' ' 48' ' ' VAL . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.601 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.548 HG23 HD22 ' A' ' 82' ' ' LEU . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.629 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.827 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.509 ' HE1' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.764 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.636 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 68' ' ' ARG . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' 62' ' ' ILE . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.407 ' O ' HD13 ' A' ' 69' ' ' LEU . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.88 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.681 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 67' ' ' ASN . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.636 HD11 ' OG ' ' A' ' 60' ' ' SER . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.526 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.764 HG23 ' CD1' ' A' ' 52' ' ' LEU . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' ALA . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.577 ' OE1' HG22 ' A' ' 75' ' ' ILE . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.435 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.548 HD22 HG23 ' A' ' 45' ' ' ILE . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.701 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.818 HG13 ' HB2' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.416 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 38' ' ' ILE . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 ' O ' ' A' ' 112' ' ' ILE . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 1.003 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.487 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.497 ' HD3' HG23 ' A' ' 94' ' ' VAL . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.813 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.628 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.618 ' SG ' HG22 ' A' ' 32' ' ' THR . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.739 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.401 ' C ' ' HG3' ' A' ' 34' ' ' MET . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.589 ' CD2' HD22 ' A' ' 24' ' ' LEU . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.966 HG22 HD12 ' A' ' 136' ' ' LEU . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.578 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.966 HD12 HG22 ' A' ' 133' ' ' THR . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.485 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.813 0.339 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.571 ' O ' HG22 ' A' ' 14' ' ' ILE . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.791 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.551 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.727 ' HA ' HD12 ' A' ' 24' ' ' LEU . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 21' ' ' ILE . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.857 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.418 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.892 HG22 ' OD1' ' A' ' 129' ' ' ASN . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.417 HD13 ' OH ' ' A' ' 125' ' ' TYR . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.492 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 48' ' ' VAL . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 124' ' ' LEU . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.59 HG12 HG21 ' A' ' 48' ' ' VAL . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.59 ' O ' HG11 ' A' ' 88' ' ' VAL . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.63 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.59 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.443 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.871 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.8 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.402 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.523 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.831 HD12 ' HA ' ' A' ' 68' ' ' ARG . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.556 ' H ' HG22 ' A' ' 62' ' ' ILE . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.852 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.831 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.407 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 67' ' ' ASN . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.523 HD11 ' OG ' ' A' ' 60' ' ' SER . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.871 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 52' ' ' LEU . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.412 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.436 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.746 HD23 ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 93' ' ' LEU . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CD ' HD23 ' A' ' 93' ' ' LEU . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.836 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.857 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.418 HG21 ' OD1' ' A' ' 30' ' ' ASN . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.401 HG21 ' HE2' ' A' ' 108' ' ' LYS . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HE2' HG21 ' A' ' 102' ' ' THR . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.403 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.586 ' HG3' HG23 ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.436 ' O ' HD13 ' A' ' 120' ' ' ILE . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.512 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 38' ' ' ILE . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.704 ' N ' HD23 ' A' ' 124' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.892 ' OD1' HG22 ' A' ' 32' ' ' THR . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.639 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.2 m-70 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.957 HG22 HD12 ' A' ' 136' ' ' LEU . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.957 HD12 HG22 ' A' ' 133' ' ' THR . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.751 0.31 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 14' ' ' ILE . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.701 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.832 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.431 HG23 ' O ' ' A' ' 17' ' ' ILE . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.639 HG22 ' CG ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.403 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.655 HD12 ' CB ' ' A' ' 74' ' ' ALA . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.68 HD21 ' CG1' ' A' ' 48' ' ' VAL . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.679 HG23 ' CG2' ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.742 ' CD1' HG21 ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.496 HG21 ' O ' ' A' ' 85' ' ' TYR . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.457 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.742 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.981 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.837 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.836 HD12 ' HA ' ' A' ' 68' ' ' ARG . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.564 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.451 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.7 OUTLIER -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.836 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.732 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.981 HG23 HD12 ' A' ' 52' ' ' LEU . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 74' ' ' ALA . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.605 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.676 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.676 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.496 ' O ' HG21 ' A' ' 45' ' ' ILE . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.679 ' CG2' HG23 ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.683 HG23 HD11 ' A' ' 93' ' ' LEU . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.669 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.526 HG21 ' NZ ' ' A' ' 108' ' ' LYS . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.526 ' NZ ' HG21 ' A' ' 102' ' ' THR . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.4 ' HB2' ' NH1' ' A' ' 81' ' ' ARG . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.618 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.443 ' HG3' HG23 ' A' ' 94' ' ' VAL . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.832 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.53 ' O ' HD13 ' A' ' 120' ' ' ILE . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.53 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.664 HD22 HD12 ' A' ' 126' ' ' LEU . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.496 ' N ' HD23 ' A' ' 124' ' ' LEU . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.639 ' CG ' HG22 ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.488 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.619 HG22 HD12 ' A' ' 136' ' ' LEU . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.644 ' O ' HD22 ' A' ' 139' ' ' LEU . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 14' ' ' ILE . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.549 ' O ' HD12 ' A' ' 17' ' ' ILE . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.774 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 17' ' ' ILE . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.466 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.955 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.772 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' MET . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.496 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.62 HG21 HG21 ' A' ' 78' ' ' VAL . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.74 HD21 HG11 ' A' ' 48' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.641 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.775 HG12 HG21 ' A' ' 48' ' ' VAL . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.568 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.601 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.775 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.455 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.948 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.625 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 68' ' ' ARG . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.573 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.892 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.571 HD21 ' NH2' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 67' ' ' ASN . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.625 HD11 ' OG ' ' A' ' 60' ' ' SER . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.948 HG23 HD12 ' A' ' 52' ' ' LEU . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 HG21 ' A' ' 35' ' ' ILE . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.839 HG13 ' HB2' ' A' ' 93' ' ' LEU . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.839 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 38' ' ' ILE . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.955 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.42 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.774 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.706 ' O ' HD13 ' A' ' 120' ' ' ILE . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.706 HD13 ' O ' ' A' ' 119' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.595 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.595 ' N ' HD23 ' A' ' 124' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.63 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.581 ' SG ' HG22 ' A' ' 32' ' ' THR . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' THR . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.416 ' C ' ' HG3' ' A' ' 34' ' ' MET . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.496 ' CZ ' ' HE2' ' A' ' 34' ' ' MET . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.486 ' HB2' HD21 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.671 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.605 ' HB2' ' OE2' ' A' ' 134' ' ' GLU . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.768 0.318 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.721 ' O ' HG22 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.895 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.458 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.717 ' HA ' HD12 ' A' ' 24' ' ' LEU . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.659 ' N ' HD12 ' A' ' 21' ' ' ILE . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.013 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.4 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.629 HD12 ' CB ' ' A' ' 74' ' ' ALA . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.413 HD22 HG11 ' A' ' 78' ' ' VAL . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.601 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.587 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.453 HG23 HD22 ' A' ' 82' ' ' LEU . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.487 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.758 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.877 ' HB2' HG21 ' A' ' 75' ' ' ILE . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.694 HD13 HD22 ' A' ' 67' ' ' ASN . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 69' ' ' LEU . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.819 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.6 OUTLIER -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.658 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.617 HD22 ' HG2' ' A' ' 68' ' ' ARG . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 67' ' ' ASN . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.629 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.877 HG21 ' HB2' ' A' ' 56' ' ' PHE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.453 HD22 HG23 ' A' ' 45' ' ' ILE . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.843 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.412 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.843 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.601 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.523 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 1.013 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.65 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.433 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.601 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.477 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.895 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.675 ' O ' HD13 ' A' ' 120' ' ' ILE . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 119' ' ' PRO . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.449 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.616 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.616 ' N ' HD23 ' A' ' 124' ' ' LEU . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.435 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.036 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.036 HD12 HG22 ' A' ' 133' ' ' THR . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.412 ' HA ' HD13 ' A' ' 140' ' ' LEU . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.666 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.711 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.486 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.421 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.84 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.439 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 21' ' ' ILE . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 33' ' ' SER . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.821 HG23 ' HA ' ' A' ' 128' ' ' ASP . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.48 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.58 HD12 ' CB ' ' A' ' 74' ' ' ALA . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.653 HD21 HG11 ' A' ' 48' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.67 HG12 HG21 ' A' ' 48' ' ' VAL . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.806 HG23 HD22 ' A' ' 82' ' ' LEU . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.621 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.67 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.438 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.455 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 68' ' ' ARG . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.586 ' H ' HG22 ' A' ' 62' ' ' ILE . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.874 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.796 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.429 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.455 HD21 ' OG ' ' A' ' 60' ' ' SER . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.58 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG21 ' A' ' 35' ' ' ILE . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.482 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.806 HD22 HG23 ' A' ' 45' ' ' ILE . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.847 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.847 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.761 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.677 HG22 ' CB ' ' A' ' 113' ' ' ASP . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.49 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.677 ' CB ' HG22 ' A' ' 95' ' ' VAL . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.483 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.489 ' CB ' HD11 ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.71 HG22 ' H ' ' A' ' 122' ' ' THR . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.71 ' H ' HG22 ' A' ' 120' ' ' ILE . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.4 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.614 HD22 HD12 ' A' ' 126' ' ' LEU . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.607 ' N ' HD23 ' A' ' 124' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.625 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' HG22 ' A' ' 32' ' ' THR . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.821 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.424 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 0.796 HG22 HD12 ' A' ' 136' ' ' LEU . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.796 HD12 HG22 ' A' ' 133' ' ' THR . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.566 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 140' ' ' LEU . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.831 0.348 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 14' ' ' ILE . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 17' ' ' ILE . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.922 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.579 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.595 HG22 ' CG ' ' A' ' 129' ' ' ASN . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.484 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.727 HG23 ' HE1' ' A' ' 125' ' ' TYR . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD21 HG11 ' A' ' 48' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.668 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 93' ' ' LEU . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.4 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.608 HG21 HG12 ' A' ' 39' ' ' ILE . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.436 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.898 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.476 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.457 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.597 ' OD1' HD13 ' A' ' 62' ' ' ILE . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.786 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ASN . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.898 HG23 HD12 ' A' ' 52' ' ' LEU . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.605 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.605 HD23 ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.405 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.829 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.626 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 94' ' ' VAL . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.922 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.423 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.545 ' C ' HD23 ' A' ' 124' ' ' LEU . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.727 ' HE1' HG23 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.809 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASN . . . . . 0.595 ' CG ' HG22 ' A' ' 32' ' ' THR . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PHE . . . . . 0.529 ' CD2' HD22 ' A' ' 24' ' ' LEU . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' HIS . . . . . 0.809 ' CD2' HD22 ' A' ' 126' ' ' LEU . 94.4 m-70 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . 1.052 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.66 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 1.052 HD12 HG22 ' A' ' 133' ' ' THR . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.532 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.569 HD21 HD11 ' A' ' 14' ' ' ILE . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpp? . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.27 153.81 29.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.142 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -99.78 8.49 44.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.331 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -69.04 149.88 97.68 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.688 0.28 . . . . 0.0 110.926 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.47 -30.39 92.42 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.592 2.195 . . . . 0.0 112.17 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.8 p 170.89 77.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.896 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.18 -87.28 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.479 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.66 -26.84 68.27 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.973 0.416 . . . . 0.0 110.537 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -60.66 -39.27 87.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.644 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.9 ttp180 -46.78 -30.79 2.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.258 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.592 ' O ' HG22 ' A' ' 14' ' ' ILE . 20.3 m120 -79.62 -38.64 33.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.631 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.7 t -65.25 -34.56 71.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.345 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -67.6 -41.2 84.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.926 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.95 -29.82 41.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.052 178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.457 ' CH2' ' HD2' ' A' ' 19' ' ' LYS . 8.8 t-105 -71.62 -44.69 63.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.672 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -74.01 -44.69 53.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.811 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.6 mt -60.98 -36.75 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.312 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -62.19 -42.25 99.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.105 0.478 . . . . 0.0 109.982 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HD2' ' CH2' ' A' ' 15' ' ' TRP . 0.6 OUTLIER -79.93 -28.18 39.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.921 179.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.35 -50.56 45.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.12 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.627 ' HA ' HD12 ' A' ' 24' ' ' LEU . 15.3 pt -54.61 -46.1 72.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.399 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.43 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -54.79 -44.17 73.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.297 -179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.9 p -60.23 -31.6 70.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.128 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.627 HD12 ' HA ' ' A' ' 21' ' ' ILE . 10.3 mt -78.63 -37.66 41.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.189 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.72 -26.69 68.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.212 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.06 -15.12 39.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.297 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.027 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.2 126.1 31.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.839 0.352 . . . . 0.0 111.219 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -142.51 130.88 22.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.459 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -106.7 -161.22 22.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.806 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -114.0 105.96 13.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.869 0.366 . . . . 0.0 111.829 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.656 ' O ' HG23 ' A' ' 32' ' ' THR . . . 80.89 -33.55 2.38 Favored Glycine 0 CA--C 1.521 0.468 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.293 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.656 HG23 ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER 166.11 77.4 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 117.35 0.575 . . . . 0.0 110.643 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.459 ' CB ' ' HA3' ' A' ' 29' ' ' GLY . 0.2 OUTLIER -117.62 28.09 8.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.285 -179.669 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 0.9 OUTLIER -136.91 112.7 9.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.855 0.359 . . . . 0.0 110.304 179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.719 HG21 HG21 ' A' ' 78' ' ' VAL . 17.4 mt -107.69 120.81 59.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.219 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.468 ' HB2' HD23 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.54 121.71 45.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.859 178.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 38' ' ' ILE . 15.9 tp -129.74 124.53 33.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.034 0.445 . . . . 0.0 111.748 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.77 HD12 ' C ' ' A' ' 37' ' ' LEU . 2.0 mp -123.94 124.19 68.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.083 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.739 HG12 HG21 ' A' ' 48' ' ' VAL . 15.0 mt -116.2 138.04 23.92 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.538 -179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.582 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.59 156.09 33.53 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.59 2.194 . . . . 0.0 112.368 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.6 -39.1 37.25 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.676 2.251 . . . . 0.0 112.406 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.3 mttt -83.06 -16.17 48.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.28 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.86 163.8 21.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.811 0.339 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -107.41 145.27 33.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.459 HG23 HD22 ' A' ' 82' ' ' LEU . 21.2 mm -57.12 -53.67 40.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.558 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 69.6 m -55.38 -30.61 60.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.751 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -55.48 26.85 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.709 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.739 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -56.78 -28.55 28.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 179.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.45 -32.06 37.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.876 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -73.56 -43.26 60.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.261 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.409 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -67.69 -42.42 82.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.201 179.359 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.835 HD21 ' HB ' ' A' ' 78' ' ' VAL . 0.6 OUTLIER -69.02 -52.97 23.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.312 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -52.1 -30.0 24.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.48 -48.54 72.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.597 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -74.74 -25.04 58.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.794 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.768 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.0 t80 -66.67 -42.91 85.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.549 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.55 -39.62 49.24 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.347 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.19 -28.84 64.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.837 0.351 . . . . 0.0 110.681 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.417 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.08 -33.61 72.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.565 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -76.48 -5.02 45.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.378 179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -101.8 2.37 38.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.667 0.27 . . . . 0.0 111.382 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.708 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.2 mt -64.68 142.5 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-O 120.903 0.383 . . . . 0.0 111.015 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -64.23 -40.44 96.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.647 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 62' ' ' ILE . 19.5 t -70.77 128.44 36.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -71.95 -52.79 15.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 t -64.43 -29.79 48.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.367 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.881 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t30 -77.57 -47.12 20.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.245 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.708 ' HA ' HD12 ' A' ' 62' ' ' ILE . 3.0 ppt_? -57.83 -34.0 69.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.816 0.341 . . . . 0.0 111.124 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.7 mt -74.62 -46.75 36.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.987 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.6 t -59.5 -29.74 68.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.097 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.881 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.0 t -73.65 -53.58 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.252 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.565 HD21 ' OG ' ' A' ' 60' ' ' SER . 52.5 mt -57.76 -34.4 69.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.45 -54.31 37.08 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.709 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.487 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.04 -50.02 73.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.701 0.286 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.811 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.4 mt -54.73 -44.44 70.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.767 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.2 m -57.19 -30.05 64.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.516 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.1 m -78.28 -40.02 38.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.79 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.835 ' HB ' HD21 ' A' ' 52' ' ' LEU . 24.2 t -56.44 -57.82 7.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.763 0.316 . . . . 0.0 110.827 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.13 -35.36 71.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.64 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.3 mm-40 -56.4 -33.42 65.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.028 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -29.19 40.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.282 178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.459 HD22 HG23 ' A' ' 45' ' ' ILE . 61.3 mt -63.16 -34.98 78.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.925 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.5 ' HG2' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -69.94 -8.5 49.39 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.793 0.33 . . . . 0.0 110.719 179.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.5 HD22 ' HG2' ' A' ' 83' ' ' LYS . 3.9 mm? -93.91 -12.6 28.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.387 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -122.76 112.56 18.06 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.471 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -71.85 -23.64 61.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.045 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -155.11 168.71 26.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.953 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.833 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.1 t -82.17 133.05 51.58 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.514 0.197 . . . . 0.0 111.035 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.405 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.1 Cg_exo -47.13 164.91 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.545 2.163 . . . . 0.0 112.523 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.1 -38.88 50.99 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.682 2.254 . . . . 0.0 112.566 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.6 m-20 -89.55 -38.49 13.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.512 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.78 179.02 33.34 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.556 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.833 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -126.66 119.97 28.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.879 0.371 . . . . 0.0 110.695 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.491 HG22 ' HA ' ' A' ' 38' ' ' ILE . 95.5 t -135.6 111.85 13.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.017 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.667 HG13 ' O ' ' A' ' 112' ' ' ILE . 60.9 t -117.37 148.59 20.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.45 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.1 m-30 -129.03 117.47 20.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 110.72 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.9 m -127.9 130.69 48.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.965 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.28 168.61 41.0 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.573 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.419 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 2.3 m -115.97 112.8 22.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.736 0.303 . . . . 0.0 110.487 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 1.027 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -111.98 173.76 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 111.412 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.3 t -120.58 147.35 24.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.241 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.1 p -104.64 161.51 14.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.383 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -51.46 -35.67 40.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.054 0.454 . . . . 0.0 110.454 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -65.24 -14.55 60.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.503 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.79 3.83 63.94 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.883 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -90.89 135.06 33.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 110.763 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -87.98 118.44 27.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.762 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -121.68 121.44 37.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.825 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -74.87 140.4 43.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.421 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 43.4 t -111.61 106.95 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.749 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -118.17 110.53 17.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.907 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.667 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.15 140.16 49.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.487 ' CB ' HG22 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -136.51 131.86 34.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.423 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.454 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.9 p90 -169.92 170.19 7.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.947 0.403 . . . . 0.0 111.56 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.405 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 5.6 pt-20 -90.92 145.56 32.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.2 178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.4 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 28.6 Cg_endo -62.72 167.39 11.87 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.412 2.075 . . . . 0.0 112.582 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.926 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.4 t80 -59.3 -37.52 77.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.956 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -147.86 168.6 10.85 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.44 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.579 ' O ' HD13 ' A' ' 120' ' ' ILE . 52.0 Cg_exo -54.83 132.74 53.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.274 1.983 . . . . 0.0 112.328 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.579 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.1 mm -128.09 112.77 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.34 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.69 43.62 1.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.875 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.0 m -155.2 112.35 3.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.698 0.285 . . . . 0.0 111.344 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.41 ' HB3' ' HD3' ' A' ' 40' ' ' PRO . 14.0 p -78.04 110.88 13.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.091 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.81 ' CD2' HD11 ' A' ' 126' ' ' LEU . 7.1 tt -108.9 119.22 38.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.647 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.702 ' C ' HD13 ' A' ' 126' ' ' LEU . 34.3 t80 -131.66 120.43 22.78 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.334 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.81 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.55 152.53 34.27 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.59 0.71 . . . . 0.0 112.393 179.619 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 52.6 t -121.67 127.02 50.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.335 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 32' ' ' THR . 3.9 t70 -157.86 -174.49 4.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.027 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.428 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.5 m120 -75.58 -1.93 26.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -154.52 145.61 22.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.812 0.339 . . . . 0.0 111.236 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.45 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 58.9 m-85 -67.52 130.02 41.74 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.804 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -83.73 103.62 13.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.548 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.74 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -95.4 28.2 3.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.127 -179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.686 ' HA ' HG22 ' A' ' 137' ' ' THR . 5.7 pt-20 -63.99 -44.34 92.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.847 0.356 . . . . 0.0 110.588 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.08 -32.91 74.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.541 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.74 HD12 HG22 ' A' ' 133' ' ' THR . 27.5 mt -78.41 -46.14 20.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.432 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.686 HG22 ' HA ' ' A' ' 134' ' ' GLU . 6.2 t -73.61 -15.1 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.027 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.01 -44.41 70.88 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.56 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.63 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -62.48 -56.58 16.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 110.786 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -60.83 -38.26 84.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.876 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 70.6 m -73.8 -31.38 63.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.812 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.951 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 mtm . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.831 0.348 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.25 168.33 4.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -92.11 -26.86 18.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.52 146.11 41.07 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.835 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -68.12 -87.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 122.469 2.112 . . . . 0.0 112.397 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.6 p 174.12 136.27 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.706 0.289 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.64 -40.34 95.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.276 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.76 -31.62 70.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.113 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.27 -34.21 61.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 7.5 mtp180 -51.3 -32.86 26.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.172 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 14' ' ' ILE . 28.6 m120 -69.01 -45.38 70.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.996 0.426 . . . . 0.0 110.25 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.472 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.8 t -53.4 -41.04 43.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.619 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -55.9 -40.38 72.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.274 0.559 . . . . 0.0 109.504 178.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.734 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -59.86 -30.92 46.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.1 178.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.472 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.7 t-105 -75.1 -44.91 44.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.678 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -71.74 -44.54 63.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.957 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.616 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.0 OUTLIER -62.69 -37.3 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.459 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -60.47 -49.86 75.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -79.83 -22.1 43.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.198 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.84 -52.25 11.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.319 . . . . 0.0 111.077 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.616 HG23 ' O ' ' A' ' 17' ' ' ILE . 16.0 pt -51.94 -46.14 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.39 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -55.19 -46.22 75.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.231 -179.889 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.4 t -61.12 -30.77 70.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.108 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' A' ' 131' ' ' PHE . 42.8 mt -78.67 -26.31 45.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 5.0 mt-10 -75.99 -24.28 55.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.571 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.56 -16.78 29.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 110.878 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.905 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.82 122.54 27.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.182 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.6 130.32 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.752 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -100.26 -176.21 30.23 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.725 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -113.83 96.62 5.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.766 0.317 . . . . 0.0 110.874 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.8 30.28 4.06 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.678 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' A' ' 128' ' ' ASP . 40.8 p 48.75 64.0 1.88 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.693 0.282 . . . . 0.0 111.292 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.7 t -106.48 29.48 6.84 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.035 0.445 . . . . 0.0 110.532 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.588 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.7 OUTLIER -106.86 125.43 51.0 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 179.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.688 HG23 ' HE1' ' A' ' 125' ' ' TYR . 26.7 mt -114.18 128.36 71.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.3 0.571 . . . . 0.0 112.525 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.522 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 19.4 m -110.67 122.07 46.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.683 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD21 HG11 ' A' ' 48' ' ' VAL . 51.0 tp -130.67 125.23 33.44 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.743 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.91 123.92 67.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.901 178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.592 HG12 HG21 ' A' ' 48' ' ' VAL . 15.1 mt -115.73 134.73 22.64 Favored Pre-proline 0 C--N 1.328 -0.337 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 51.3 Cg_exo -54.15 155.95 14.31 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.574 2.182 . . . . 0.0 112.358 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.72 -39.28 21.09 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.714 2.276 . . . . 0.0 112.716 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -81.56 -16.22 52.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.298 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.57 157.55 35.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.592 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -102.14 146.7 27.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.691 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.851 HG23 HD22 ' A' ' 82' ' ' LEU . 18.7 mm -56.65 -53.93 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.0 OUTLIER -55.93 -32.71 64.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.116 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.19 -54.87 29.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.654 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.592 HG21 HG12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -60.59 -24.33 31.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.758 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.57 -38.6 60.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.849 0.357 . . . . 0.0 110.873 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -68.05 -49.15 63.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.54 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.429 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -61.45 -43.28 99.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.582 179.648 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.9 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.2 OUTLIER -71.51 -56.54 5.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.724 179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.88 -27.23 7.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.943 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.64 -42.13 98.16 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.619 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -77.71 -22.74 49.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.942 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 82.7 t80 -66.72 -46.27 76.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.729 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.68 84.76 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.07 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.4 m -69.15 -27.05 65.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.42 -34.78 75.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.18 -5.21 45.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.35 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-20 -100.79 2.55 41.29 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.69 0.281 . . . . 0.0 111.215 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.5 mt -65.8 146.31 13.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.877 0.37 . . . . 0.0 110.931 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -72.82 -36.06 67.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.07 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.596 ' H ' HG22 ' A' ' 62' ' ' ILE . 11.4 t -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.137 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -71.95 -55.26 7.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.046 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.88 -39.81 84.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.376 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.906 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.5 OUTLIER -59.11 -50.2 74.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.058 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.893 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -60.51 -35.51 76.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.835 -179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.6 mt -74.66 -36.76 62.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.863 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 t -70.17 -36.26 74.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.099 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.906 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.9 t -68.92 -53.64 25.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.116 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.643 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 34.4 mt -58.93 -31.54 68.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.892 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.74 -57.06 21.39 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.51 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.713 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.86 -44.35 94.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.776 0.322 . . . . 0.0 110.978 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.9 HG23 ' CD1' ' A' ' 52' ' ' LEU . 74.0 mt -59.42 -41.93 86.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.703 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -59.36 -31.62 69.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.547 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.9 m -78.91 -44.21 23.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.75 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.713 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.0 t -52.36 -51.37 33.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.988 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.3 mt-30 -61.6 -36.67 81.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.71 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.465 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.1 mm-40 -58.64 -32.81 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.44 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.455 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -77.18 -34.63 56.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.533 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.851 HD22 HG23 ' A' ' 45' ' ' ILE . 95.4 mt -62.64 -36.71 83.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.313 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.474 ' HG2' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -61.04 -11.48 8.5 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.224 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.474 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.7 mt -97.14 -20.62 17.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.929 0.395 . . . . 0.0 110.347 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -115.3 112.24 22.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.55 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -71.85 -41.65 67.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.013 0.435 . . . . 0.0 110.516 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.65 169.34 16.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.719 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.811 HG13 ' HB2' ' A' ' 93' ' ' LEU . 54.3 t -79.82 133.13 59.05 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.595 0.236 . . . . 0.0 110.985 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 85.4 Cg_exo -47.46 164.94 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.46 2.106 . . . . 0.0 112.541 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.99 -38.12 48.39 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.699 2.266 . . . . 0.0 112.506 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 8.8 m-20 -91.44 -37.39 13.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.498 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.406 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.1 176.47 29.2 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.477 -179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.811 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -123.35 120.07 31.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.895 0.379 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.743 HG22 ' HA ' ' A' ' 38' ' ' ILE . 75.8 t -135.26 112.02 13.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.712 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.643 HG13 ' O ' ' A' ' 112' ' ' ILE . 46.4 t -117.49 149.66 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.531 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -130.26 128.99 42.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.016 0.436 . . . . 0.0 111.123 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 99.3 m -139.43 129.65 25.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.634 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.588 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.47 168.65 41.11 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.547 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.9 m -108.94 126.62 53.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.704 0.288 . . . . 0.0 110.677 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.905 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -129.07 169.46 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.169 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.9 t -122.49 149.63 26.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.486 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 61.7 p -104.75 162.88 12.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.224 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.25 -38.38 40.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.122 0.487 . . . . 0.0 110.323 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.94 -14.69 37.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.729 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.14 27.47 25.69 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.333 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -110.87 134.35 52.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.997 0.427 . . . . 0.0 111.1 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -85.85 118.49 25.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.5 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.97 121.44 35.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.898 0.38 . . . . 0.0 111.366 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.43 140.37 46.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.5 t -119.46 106.94 20.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.012 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -115.8 110.58 19.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.412 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.643 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -125.95 140.01 49.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.593 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -136.9 131.94 33.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.316 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -169.93 166.66 9.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.771 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.71 145.75 37.64 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.991 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.406 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 50.5 Cg_endo -68.85 159.71 52.72 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.374 2.049 . . . . 0.0 113.109 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.734 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.9 t80 -53.07 -41.48 64.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.263 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 mmmm -141.34 163.68 40.13 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.549 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.506 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.77 132.69 46.66 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.144 1.896 . . . . 0.0 112.206 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.506 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.33 112.99 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.242 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -89.02 46.53 1.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.621 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.7 m -154.27 112.16 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 111.267 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -79.94 110.36 15.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.015 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.676 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -108.45 132.5 53.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.011 0.434 . . . . 0.0 111.906 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.696 ' CE2' HD22 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -130.44 113.29 14.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.019 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.866 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -137.96 132.95 33.1 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.03 0.443 . . . . 0.0 111.852 -179.083 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 34' ' ' MET . 23.6 t -121.24 129.54 53.23 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.259 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.414 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.9 t70 -160.95 -161.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.651 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.408 ' N ' HG22 ' A' ' 32' ' ' THR . 73.7 m-80 -81.99 5.13 20.19 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.625 0.25 . . . . 0.0 111.58 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -160.96 152.18 18.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 110.536 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 77.7 m-85 -66.87 125.33 25.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.5 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.866 ' CD2' HD22 ' A' ' 126' ' ' LEU . 80.9 m-70 -93.92 86.82 5.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.963 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.843 HG22 HD12 ' A' ' 136' ' ' LEU . 2.2 p -82.4 57.24 3.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.839 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 36.4 tp10 -70.49 -54.11 13.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.771 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.66 -26.15 66.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.254 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.843 HD12 HG22 ' A' ' 133' ' ' THR . 24.2 mt -79.81 -51.05 9.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.984 0.421 . . . . 0.0 110.705 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 30.8 m -77.78 -16.53 58.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.167 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.638 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.38 -34.79 67.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.369 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER -74.38 -56.97 4.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.827 -179.7 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.64 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.0 mp -55.28 -30.3 59.88 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.341 . . . . 0.0 111.043 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 19.1 m -83.79 -31.37 25.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.886 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.962 179.903 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.799 0.333 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.76 169.13 12.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.103 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -83.78 2.14 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.286 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -75.79 150.27 83.81 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.4 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -40.05 -81.61 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.678 2.252 . . . . 0.0 112.68 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 9' ' ' ASP . 59.6 p -127.99 146.6 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.799 0.333 . . . . 0.0 111.012 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -108.55 -68.99 0.88 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.15 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.83 -29.81 67.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 6' ' ' SER . 0.8 OUTLIER -60.62 -37.32 81.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.827 179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HG2' ' CE1' ' A' ' 117' ' ' PHE . 4.4 ttm180 -47.41 -34.22 6.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.114 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.508 ' O ' HG22 ' A' ' 14' ' ' ILE . 10.5 m120 -75.93 -40.67 53.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.369 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.8 t -58.24 -38.49 68.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.463 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -61.09 -40.35 93.39 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.508 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -60.34 -31.56 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.045 178.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.413 ' CZ2' ' HE3' ' A' ' 19' ' ' LYS . 8.4 t-105 -72.11 -45.24 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.671 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mmtp -73.37 -44.86 57.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.0 109.751 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 21' ' ' ILE . 2.4 mt -61.18 -37.46 77.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.338 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -57.6 -48.71 78.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.245 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HE3' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -79.97 -21.12 44.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.078 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.438 ' HB2' ' HA ' ' A' ' 17' ' ' ILE . 1.9 mt -76.92 -48.01 19.41 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.652 0.263 . . . . 0.0 111.204 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 17' ' ' ILE . 14.8 pt -55.97 -46.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.219 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.14 -45.31 71.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.194 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.3 m -60.06 -32.67 71.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.05 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.547 HD22 ' CD2' ' A' ' 131' ' ' PHE . 80.1 mt -78.62 -27.08 45.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.282 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -74.73 -27.31 60.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.29 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.8 33.73 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.133 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.655 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.49 124.85 29.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.21 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.12 130.52 21.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.82 -175.4 26.85 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.503 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -113.86 98.38 6.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.891 0.377 . . . . 0.0 111.091 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.99 27.57 5.07 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.745 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.581 HG22 ' ND2' ' A' ' 129' ' ' ASN . 65.5 p 49.92 62.94 2.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.747 0.308 . . . . 0.0 111.361 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.02 24.99 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.011 0.434 . . . . 0.0 110.66 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.606 ' HE2' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -102.87 126.82 50.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.497 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.401 HD12 ' CB ' ' A' ' 74' ' ' ALA . 63.8 mt -113.83 129.18 70.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.253 0.549 . . . . 0.0 112.309 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.477 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.43 122.48 47.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.748 178.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.714 HD21 HG11 ' A' ' 48' ' ' VAL . 48.6 tp -128.62 120.92 27.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.966 0.412 . . . . 0.0 112.101 -178.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.852 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.7 mp -120.29 122.31 67.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.797 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.567 HG12 HG21 ' A' ' 48' ' ' VAL . 17.9 mt -116.25 133.57 22.92 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.613 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.8 Cg_exo -54.73 156.21 15.54 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.737 2.291 . . . . 0.0 112.484 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.04 -39.2 25.0 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.729 2.286 . . . . 0.0 112.913 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.3 mmtm -83.17 -16.45 46.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.676 0.274 . . . . 0.0 111.369 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.466 ' HB3' HG22 ' A' ' 39' ' ' ILE . 17.1 t70 -67.12 162.25 22.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.676 0.274 . . . . 0.0 110.551 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.34 148.75 26.72 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.882 0.372 . . . . 0.0 110.919 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.81 HG23 HD22 ' A' ' 82' ' ' LEU . 13.2 mm -60.16 -53.69 45.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.2 m -54.59 -33.01 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.225 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.0 tpt180 -52.45 -53.75 41.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.795 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.714 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -58.65 -24.68 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.902 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.99 -36.31 60.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.133 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.87 -33.57 62.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.699 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.405 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -73.21 -42.85 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.396 179.507 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.955 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -73.65 -55.58 6.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.606 179.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.89 -27.43 7.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.877 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -63.28 -44.73 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.554 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.42 -21.99 52.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.917 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.781 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.7 t80 -66.04 -45.89 79.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.743 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.63 -42.76 79.22 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.377 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 m -68.56 -27.25 65.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.826 0.346 . . . . 0.0 110.868 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.49 -31.44 70.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -79.15 -3.52 45.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.282 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -102.79 1.96 34.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.36 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 68' ' ' ARG . 65.1 mt -65.07 144.64 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.938 0.399 . . . . 0.0 110.879 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -69.94 -36.08 75.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.768 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.627 ' H ' HG22 ' A' ' 62' ' ' ILE . 32.0 t -73.34 132.54 43.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.997 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -71.95 -54.24 10.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.984 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.51 -34.57 71.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.588 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.3 t30 -70.02 -49.58 49.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.186 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.737 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -56.47 -34.73 67.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.01 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.476 HD21 ' NH2' ' A' ' 68' ' ' ARG . 28.7 mt -74.77 -45.43 43.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -61.23 -33.43 73.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.104 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.2 t -68.55 -53.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.042 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 18.5 mt -60.56 -31.27 70.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.86 -57.47 19.2 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.461 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.647 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.24 -43.94 92.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.726 0.298 . . . . 0.0 110.944 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.955 HG23 HD12 ' A' ' 52' ' ' LEU . 84.2 mt -59.5 -40.01 80.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.5 m -60.56 -30.85 70.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.622 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.2 m -79.85 -44.39 20.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.799 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.647 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.2 t -50.6 -51.29 19.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.057 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -63.99 -34.87 78.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.444 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.467 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.9 mm-40 -60.59 -27.99 68.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.59 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -82.57 -33.47 28.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.74 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.81 HD22 HG23 ' A' ' 45' ' ' ILE . 84.1 mt -64.36 -36.17 83.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.574 179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -61.58 -12.63 16.45 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 83' ' ' LYS . 1.3 mt -95.43 -18.6 20.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.97 0.414 . . . . 0.0 110.224 178.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -115.27 114.37 25.1 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.627 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -71.92 -43.28 65.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.019 0.438 . . . . 0.0 110.63 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -134.3 171.63 13.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.762 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.819 HG13 ' HB2' ' A' ' 93' ' ' LEU . 59.3 t -80.88 133.08 55.58 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.628 0.251 . . . . 0.0 111.151 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.432 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.6 Cg_exo -47.61 164.96 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.68 2.253 . . . . 0.0 112.621 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.84 -39.97 48.47 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.762 2.308 . . . . 0.0 112.609 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -89.19 -36.71 15.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.459 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.414 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 156.78 -179.89 32.25 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.406 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.819 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -126.75 120.07 28.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.933 0.397 . . . . 0.0 110.626 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.852 HG22 ' HA ' ' A' ' 38' ' ' ILE . 74.5 t -135.86 112.15 12.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.683 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.633 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.3 t -117.3 150.02 19.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.499 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.6 m-30 -130.4 132.0 45.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.995 0.426 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 67.0 m -141.24 129.81 22.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.805 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.606 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.63 41.03 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.493 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 69.1 m -115.59 120.88 40.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.747 0.308 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.655 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -119.44 171.96 7.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.977 0.418 . . . . 0.0 111.287 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.05 149.32 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.322 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 64.7 p -104.82 161.77 13.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.214 179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.0 -36.11 37.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.081 0.467 . . . . 0.0 110.39 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.3 mp0 -64.32 -14.59 57.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.574 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.69 25.7 26.9 Favored Glycine 0 C--N 1.334 0.432 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.587 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -110.38 134.35 52.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.908 0.385 . . . . 0.0 110.741 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -88.64 118.46 28.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.651 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -121.03 121.6 38.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.087 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -73.22 140.27 46.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.966 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 35.1 t -116.74 106.9 21.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.878 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -116.52 110.56 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.537 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.73 140.58 48.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.609 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -134.65 132.0 38.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.228 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -169.63 168.64 9.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.048 0.452 . . . . 0.0 111.65 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 3.4 pm0 -94.14 140.34 22.83 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.023 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.414 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 11.9 Cg_endo -55.55 168.14 1.71 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.325 2.016 . . . . 0.0 112.282 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 1.023 ' HB3' HD21 ' A' ' 139' ' ' LEU . 9.9 t80 -67.17 -36.74 82.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.674 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.537 ' HB2' HD13 ' A' ' 139' ' ' LEU . 0.1 OUTLIER -140.91 164.19 37.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.322 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.1 Cg_endo -59.69 132.78 47.41 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.175 1.917 . . . . 0.0 112.318 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.6 mm -128.32 112.97 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.312 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -89.33 44.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.9 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m -154.16 112.16 3.53 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.694 0.283 . . . . 0.0 111.266 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 9.3 p -81.61 111.86 18.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.879 0.371 . . . . 0.0 111.358 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.4 tt -110.73 127.11 55.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.698 -179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.652 ' N ' HD23 ' A' ' 124' ' ' LEU . 40.3 t80 -130.52 118.96 21.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.8 152.18 33.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.357 0.599 . . . . 0.0 112.202 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 34' ' ' MET . 8.8 t -124.19 129.3 50.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -152.63 -168.54 3.08 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.786 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.581 ' ND2' HG22 ' A' ' 32' ' ' THR . 73.3 m-80 -82.24 5.92 18.41 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.561 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.67 153.98 17.68 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.547 ' CD2' HD22 ' A' ' 24' ' ' LEU . 70.6 m-85 -71.83 125.15 26.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -89.08 97.4 11.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.962 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -96.01 25.93 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.899 179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.6 mt-10 -61.22 -54.04 49.27 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.601 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.02 -22.09 64.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.543 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.962 HD12 HG22 ' A' ' 133' ' ' THR . 13.0 mt -79.95 -52.64 7.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.985 0.421 . . . . 0.0 110.904 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 59.5 m -81.45 -17.72 47.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.37 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -60.93 -37.34 81.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.403 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 1.023 HD21 ' HB3' ' A' ' 117' ' ' PHE . 1.8 pp -59.29 -53.5 57.52 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.044 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.809 HD22 ' CD1' ' A' ' 139' ' ' LEU . 1.9 mm? -56.2 -40.75 74.47 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.818 0.342 . . . . 0.0 110.695 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.34 -43.28 70.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.946 179.944 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.755 0.312 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.727 ' HB3' ' OD1' ' A' ' 4' ' ' ASP . . . -57.43 168.37 0.81 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.01 0.433 . . . . 0.0 111.354 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -86.89 8.9 21.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.706 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.727 ' OD1' ' HB3' ' A' ' 2' ' ' ALA . 2.0 p-10 -53.43 133.16 53.43 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.628 0.251 . . . . 0.0 111.068 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 16.0 Cg_exo -67.81 -10.55 29.18 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.731 2.287 . . . . 0.0 112.888 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 5.8 p 165.94 80.48 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.791 0.329 . . . . 0.0 110.896 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB2' ' OD2' ' A' ' 4' ' ' ASP . . . -68.69 -87.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.525 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.23 -24.3 67.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.898 0.38 . . . . 0.0 110.753 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.6 OUTLIER -65.33 -39.74 92.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.963 179.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 4.4 mtm180 -50.16 -30.55 11.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.504 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.4 m120 -77.04 -40.73 45.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.696 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 34.3 t -57.08 -39.67 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.661 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.579 ' O ' HD12 ' A' ' 17' ' ' ILE . 0.9 OUTLIER -58.78 -40.42 83.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.211 0.529 . . . . 0.0 109.644 179.047 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.759 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -61.09 -32.36 52.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.144 178.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.418 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.3 t-105 -71.29 -45.71 62.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.151 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 18.2 mmmt -74.08 -44.57 53.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 110.094 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.579 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -62.51 -29.98 48.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 179.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 8.1 ttmm -67.69 -46.32 72.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.94 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HZ3' ' HB3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -78.47 -21.08 49.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.268 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -79.21 -52.92 7.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.847 0.356 . . . . 0.0 111.038 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.726 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.5 pp -49.56 -49.66 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.447 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.726 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -54.91 -44.66 74.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.228 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.49 -31.11 71.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.264 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -78.68 -28.6 45.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.3 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.5 mt-10 -70.17 -25.27 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.451 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -90.07 -16.16 30.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.857 0.361 . . . . 0.0 110.968 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.802 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.33 126.76 33.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.225 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -140.54 130.61 24.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.987 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -94.51 -179.01 38.16 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.597 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.01 102.34 10.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.918 0.39 . . . . 0.0 110.947 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 99.44 25.51 9.31 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.651 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.685 HG22 ' OD1' ' A' ' 129' ' ' ASN . 10.5 p 55.67 64.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.912 0.387 . . . . 0.0 111.082 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.39 25.76 11.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.769 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.402 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -100.29 125.96 46.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.756 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.406 ' CD1' ' HB3' ' A' ' 74' ' ' ALA . 58.0 mt -111.62 127.77 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.195 0.522 . . . . 0.0 112.198 -178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.485 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -111.05 121.31 45.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.889 178.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.772 HD21 HG11 ' A' ' 48' ' ' VAL . 53.1 tp -129.89 122.69 29.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.111 0.481 . . . . 0.0 112.241 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.761 HD13 HD22 ' A' ' 124' ' ' LEU . 3.2 mp -121.27 122.98 68.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.034 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.694 HG12 HG21 ' A' ' 48' ' ' VAL . 13.4 mt -115.83 133.56 22.83 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.787 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.578 ' O ' HG11 ' A' ' 88' ' ' VAL . 46.0 Cg_exo -56.26 156.21 21.87 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.762 2.308 . . . . 0.0 112.535 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.53 -39.4 55.43 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.799 2.333 . . . . 0.0 112.962 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.36 -16.56 48.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.536 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.71 155.23 38.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.695 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -100.61 147.74 25.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.9 mm -57.93 -53.85 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.553 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 9.6 m -56.01 -30.45 61.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.863 0.363 . . . . 0.0 110.873 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -54.58 37.34 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.544 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.772 HG11 HD21 ' A' ' 37' ' ' LEU . 1.1 t -59.05 -24.83 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.81 -31.05 25.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.0 mttm -76.06 -50.42 14.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.541 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.58 -44.25 89.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.62 179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.068 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.25 -57.31 5.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.558 179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.03 -28.67 10.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.701 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.28 -44.95 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.465 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.94 -22.29 53.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.852 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.807 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.1 t80 -64.83 -46.42 82.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.604 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.74 -42.93 94.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.354 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.5 m -69.92 -27.45 64.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.858 0.361 . . . . 0.0 110.928 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.521 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -59.2 -34.02 71.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.058 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.581 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -79.21 -2.4 40.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.296 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -103.14 2.06 34.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.334 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.646 ' CD1' HG21 ' A' ' 71' ' ' VAL . 74.3 mt -64.85 143.78 15.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.863 0.364 . . . . 0.0 110.993 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.84 -40.51 95.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.268 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.525 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -72.74 132.13 43.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.997 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -51.27 32.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.5 t -66.01 -35.31 74.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.979 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.774 ' O ' HG23 ' A' ' 71' ' ' VAL . 18.2 t-20 -65.57 -54.18 31.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.106 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.608 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -54.09 -33.98 59.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.965 -179.777 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.406 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 33.3 mt -74.7 -39.95 61.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.757 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -68.0 -34.81 77.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.922 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.774 HG23 ' O ' ' A' ' 67' ' ' ASN . 23.3 t -68.85 -53.59 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.876 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.581 HD11 ' OG ' ' A' ' 60' ' ' SER . 17.8 mt -60.31 -31.14 69.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.9 -55.98 27.32 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.455 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.687 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.2 -44.5 95.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.809 0.337 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 1.068 HG23 HD12 ' A' ' 52' ' ' LEU . 77.7 mt -60.17 -41.83 88.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.788 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.8 m -60.8 -31.39 70.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.622 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.18 -40.27 45.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.701 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -57.1 -47.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.927 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -61.4 -39.28 90.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.607 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -60.26 -32.46 71.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.585 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.457 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 6.3 mmt85 -82.79 -36.93 25.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.2 mt -61.71 -36.91 82.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.78 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.717 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.79 -4.12 18.59 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.467 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.717 HD23 ' HD3' ' A' ' 83' ' ' LYS . 6.6 mt -96.87 -10.03 27.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.975 0.417 . . . . 0.0 109.973 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -115.41 114.63 25.34 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.465 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -71.83 -24.16 61.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.884 0.373 . . . . 0.0 110.762 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.6 170.86 21.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.882 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.814 HG13 ' HB2' ' A' ' 93' ' ' LEU . 74.1 t -82.15 133.19 51.42 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.519 0.199 . . . . 0.0 110.976 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 89.8 Cg_exo -45.38 164.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.568 2.179 . . . . 0.0 112.603 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -51.55 -36.16 58.9 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.604 2.202 . . . . 0.0 112.475 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -92.46 -37.91 12.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.562 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.19 173.35 26.49 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.814 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -120.08 122.0 40.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.003 0.401 . . . . 0.0 110.586 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.569 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.8 t -135.55 111.8 13.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.051 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.679 HG13 ' O ' ' A' ' 112' ' ' ILE . 61.1 t -117.42 149.08 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.3 m-30 -130.19 123.21 29.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.953 0.406 . . . . 0.0 110.927 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 74.9 m -131.81 130.59 41.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.9 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.17 168.57 40.93 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.433 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 62.9 m -110.96 123.97 51.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.746 0.307 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.802 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -115.33 159.46 15.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.5 t -117.05 143.39 27.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.238 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 59.1 p -104.48 161.71 13.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.616 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -53.12 -30.33 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.956 0.408 . . . . 0.0 110.673 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -67.9 -14.45 62.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.439 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 23.32 32.61 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.553 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -110.59 137.07 48.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.908 0.385 . . . . 0.0 110.781 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -91.58 119.31 31.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -117.21 121.52 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 111.043 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -73.96 140.29 45.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.24 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.498 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 16.4 t -117.6 106.93 20.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.634 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.63 110.53 18.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.732 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.679 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.01 141.02 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.413 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.531 ' CB ' HG22 ' A' ' 95' ' ' VAL . 10.6 p30 -138.04 132.02 31.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.562 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -169.86 168.2 8.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.954 0.407 . . . . 0.0 111.495 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -87.77 145.76 37.56 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.247 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.7 168.13 19.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.463 2.109 . . . . 0.0 112.773 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.759 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -59.95 -41.49 91.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.998 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 164.6 33.57 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.325 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.433 ' O ' HD13 ' A' ' 120' ' ' ILE . 19.2 Cg_endo -60.4 132.51 44.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.159 1.906 . . . . 0.0 112.246 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.433 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.31 112.85 27.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.366 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -88.51 48.05 1.58 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.846 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 22.5 m -154.57 112.18 3.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.686 0.279 . . . . 0.0 111.286 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.516 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -75.0 110.36 9.23 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.889 0.376 . . . . 0.0 111.34 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.827 ' CD2' HD11 ' A' ' 126' ' ' LEU . 9.1 tt -106.57 118.92 37.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.353 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.788 ' C ' HD13 ' A' ' 126' ' ' LEU . 47.0 t80 -131.58 118.42 20.08 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.51 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.827 HD11 ' CD2' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -150.78 152.34 33.67 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.402 0.62 . . . . 0.0 112.21 179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 34' ' ' MET . 4.9 t -121.08 127.5 51.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.711 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -155.85 -165.63 2.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.92 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.685 ' OD1' HG22 ' A' ' 32' ' ' THR . 1.0 OUTLIER -80.79 3.27 22.98 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.531 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -165.46 156.92 14.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.334 . . . . 0.0 110.751 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.456 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 56.6 m-85 -72.93 125.33 27.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.584 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 60.6 m-70 -81.91 100.43 9.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.833 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.467 ' CB ' ' HG1' ' A' ' 137' ' ' THR . 23.3 p -86.6 53.2 2.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.798 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.4 tt0 -68.29 -49.27 61.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.873 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.48 -29.52 59.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.218 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.6 ' O ' HD22 ' A' ' 139' ' ' LEU . 64.9 mt -79.83 -49.06 12.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.747 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' A' ' 133' ' ' THR . 6.9 m -78.46 -5.2 51.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.014 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.23 -37.5 80.88 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.738 0.304 . . . . 0.0 111.295 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -69.1 -57.34 5.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.458 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.556 HD11 HG13 ' A' ' 14' ' ' ILE . 10.5 mp -55.91 -39.53 71.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.018 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.1 p -70.65 -29.98 66.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.862 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.171 -0.918 . . . . 0.0 110.893 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.66 167.49 7.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -89.5 8.47 30.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.335 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.29 150.01 70.14 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.85 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.33 -27.24 47.4 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.645 2.23 . . . . 0.0 112.071 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 12.8 p 173.85 76.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.56 -86.14 0.06 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.481 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.54 -22.98 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 110.617 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 -39.5 86.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.758 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -46.93 -33.83 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.194 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.596 ' O ' HG22 ' A' ' 14' ' ' ILE . 19.1 m120 -76.32 -39.77 53.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.526 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 33.6 t -66.9 -32.74 59.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.21 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -72.23 -41.19 67.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.486 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.968 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.31 -29.72 38.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.887 178.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 11.0 t-105 -69.65 -43.68 72.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.445 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.417 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.9 mmtt -75.76 -44.34 42.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.175 0.512 . . . . 0.0 109.732 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.551 HD13 ' HD1' ' A' ' 117' ' ' PHE . 1.4 mt -60.0 -36.6 68.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.25 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 ttmt -62.59 -48.28 80.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.199 0.523 . . . . 0.0 109.792 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 22.9 mtpt -74.13 -25.55 59.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.737 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mt -71.8 -52.67 16.39 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.257 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.45 HG13 ' N ' ' A' ' 22' ' ' LYS . 12.1 pt -56.18 -50.92 68.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.144 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.2 mtpm? -55.72 -37.24 68.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.756 0.312 . . . . 0.0 111.081 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.4 m -63.77 -32.98 74.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.808 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.4 mt -78.69 -38.09 40.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -61.45 -29.43 69.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.44 -17.56 38.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.154 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.019 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.86 127.43 33.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.48 135.43 23.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.021 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.84 175.12 15.81 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.345 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.14 99.13 7.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.746 0.308 . . . . 0.0 111.655 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.0 31.56 3.56 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.583 -0.817 . . . . 0.0 113.066 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.774 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 71.7 65.01 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 0.0 110.653 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 99' ' ' THR . 0.4 OUTLIER -107.33 31.15 5.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.466 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.92 111.59 9.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.25 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.644 HD12 ' CB ' ' A' ' 74' ' ' ALA . 13.5 mt -106.34 122.01 59.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.962 0.411 . . . . 0.0 111.284 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.3 OUTLIER -109.56 120.88 43.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.746 179.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.26 122.87 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.0 111.562 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.651 HG23 ' CG2' ' A' ' 94' ' ' VAL . 2.1 mt -124.05 124.45 68.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.592 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' HB3' ' A' ' 43' ' ' ASP . 14.0 mt -116.05 138.27 24.0 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.583 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.603 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.2 Cg_exo -59.29 156.13 36.97 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.708 2.272 . . . . 0.0 112.339 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.9 -39.21 26.01 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.737 2.291 . . . . 0.0 112.506 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -15.46 45.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.454 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.412 ' HB3' HG22 ' A' ' 39' ' ' ILE . 25.9 t70 -74.65 165.4 25.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.3 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.71 149.13 29.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.844 0.354 . . . . 0.0 110.679 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.641 HG23 HD22 ' A' ' 82' ' ' LEU . 29.9 mt -63.08 -53.55 44.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.528 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.598 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.9 t -54.43 -30.49 52.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.889 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -54.89 38.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.637 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.5 t -62.32 -18.4 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.046 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.598 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.18 -31.1 41.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.878 0.371 . . . . 0.0 110.915 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.47 -52.49 15.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.464 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -60.54 -42.68 97.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.609 179.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.719 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.32 -57.39 5.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.681 179.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.17 -30.51 17.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.83 -35.04 79.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.578 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -82.83 -26.02 32.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.82 ' HB2' HG21 ' A' ' 75' ' ' ILE . 78.1 t80 -66.98 -43.46 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.675 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.52 -41.38 76.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.227 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -70.64 -27.35 63.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.805 0.336 . . . . 0.0 110.836 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.519 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.06 -34.99 70.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.039 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.591 ' OG ' HD11 ' A' ' 72' ' ' LEU . 1.8 m -74.94 -4.49 38.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.377 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.52 1.7 35.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.423 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 68' ' ' ARG . 53.7 mt -65.05 145.12 14.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.909 0.385 . . . . 0.0 111.029 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -39.94 88.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.061 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.524 ' H ' HG22 ' A' ' 62' ' ' ILE . 3.5 t -73.83 125.6 28.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.823 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 69' ' ' LEU . 2.2 tpt180 -64.9 -54.11 35.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.927 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.45 -33.75 60.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.169 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.728 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.7 t-20 -65.39 -52.02 56.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.8 ppt_? -59.85 -32.97 71.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.123 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.472 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.1 mp -74.63 -31.25 61.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.938 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.7 t -76.21 -31.35 58.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.728 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.6 t -75.74 -53.67 15.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.356 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.591 HD11 ' OG ' ' A' ' 60' ' ' SER . 25.1 mt -58.06 -38.42 76.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.879 0.371 . . . . 0.0 111.098 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.41 -52.72 49.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.549 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.644 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.67 -47.87 83.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.715 0.293 . . . . 0.0 111.06 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.82 HG21 ' HB2' ' A' ' 56' ' ' PHE . 91.5 mt -56.78 -42.41 77.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.728 179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.4 m -57.65 -31.55 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.701 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.7 m -77.55 -41.71 38.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.827 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.8 t -54.43 -57.41 6.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.04 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -57.19 -37.72 72.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.023 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 6.6 mm-40 -55.22 -37.34 67.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.561 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.1 mmp_? -74.85 -31.14 61.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.496 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.641 HD22 HG23 ' A' ' 45' ' ' ILE . 38.8 mt -64.01 -36.24 83.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.536 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.493 ' HG2' HD23 ' A' ' 84' ' ' LEU . 2.0 pttt -63.07 -11.73 21.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.241 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.493 HD23 ' HG2' ' A' ' 83' ' ' LYS . 2.5 mt -97.4 -14.47 21.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.772 0.32 . . . . 0.0 110.739 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.457 ' O ' HD12 ' A' ' 45' ' ' ILE . 2.4 m-85 -115.63 121.28 42.11 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -72.03 -30.92 65.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 111.06 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.605 ' O ' HD11 ' A' ' 45' ' ' ILE . 15.3 pttt -156.99 -179.58 8.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.939 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.803 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.7 t -82.37 132.32 53.1 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.625 0.25 . . . . 0.0 111.2 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.424 ' CD ' HD23 ' A' ' 93' ' ' LEU . 86.9 Cg_exo -47.61 165.0 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.65 2.233 . . . . 0.0 112.58 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -49.71 -39.61 47.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.731 2.288 . . . . 0.0 112.45 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.0 m-20 -88.16 -40.89 13.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.302 -179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.421 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 161.26 178.21 35.02 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.529 -0.843 . . . . 0.0 111.76 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.803 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -127.06 118.9 25.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.943 0.401 . . . . 0.0 110.658 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.651 ' CG2' HG23 ' A' ' 38' ' ' ILE . 66.8 t -135.71 111.58 12.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.874 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 64.1 t -116.0 148.25 18.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.446 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.3 m-30 -130.12 121.06 25.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.141 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 82.3 m -130.41 129.58 43.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.501 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.36 168.56 41.0 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.853 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 33' ' ' SER . 53.3 m -110.65 112.78 24.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.705 0.288 . . . . 0.0 110.511 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 1.019 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.41 171.32 4.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.379 . . . . 0.0 111.216 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 t -121.78 147.68 25.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.5 p -104.81 162.44 13.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.269 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -50.81 -38.96 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.037 0.446 . . . . 0.0 110.325 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.98 -14.65 37.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.663 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.25 -5.29 74.84 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.844 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -80.19 134.36 36.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.759 0.314 . . . . 0.0 110.728 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -86.92 118.53 26.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.679 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.66 121.68 36.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.931 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 140.3 45.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.088 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.473 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 24.7 t -110.2 106.97 21.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.898 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.92 110.59 17.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.585 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -132.5 141.53 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.712 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.521 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.8 p30 -138.95 131.57 28.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.251 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -170.04 170.32 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 111.581 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -90.27 146.03 33.91 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 92' ' ' GLY . 44.9 Cg_endo -68.54 157.04 63.5 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.401 2.067 . . . . 0.0 112.539 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.968 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 38.7 t80 -56.1 -39.05 71.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.01 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 11.3 mttm -134.09 163.92 47.67 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.438 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.471 ' O ' HD13 ' A' ' 120' ' ' ILE . 49.7 Cg_endo -69.46 132.62 24.2 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.197 1.931 . . . . 0.0 112.53 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.471 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.3 mm -128.53 112.66 27.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.149 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -86.72 49.47 1.81 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.822 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 1.4 m -153.22 112.08 3.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.69 0.281 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.31 107.57 8.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.922 HD21 HD11 ' A' ' 126' ' ' LEU . 4.0 tt -110.33 119.06 38.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.588 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.674 ' C ' HD13 ' A' ' 126' ' ' LEU . 35.7 t80 -131.71 122.33 25.72 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.347 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.922 HD11 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.6 153.12 33.86 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.663 0.744 . . . . 0.0 112.368 179.442 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.557 ' SG ' HG22 ' A' ' 32' ' ' THR . 3.6 t -121.18 126.55 49.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.656 -1.156 . . . . 0.0 109.541 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.774 ' HA ' HG23 ' A' ' 32' ' ' THR . 5.0 t70 -158.53 -176.07 5.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.091 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.444 ' C ' ' HG3' ' A' ' 34' ' ' MET . 72.3 m-20 -72.63 -4.5 31.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.721 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 pttt -154.21 145.25 22.72 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.853 0.359 . . . . 0.0 111.27 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 65.8 m-85 -63.53 155.57 29.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.779 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.465 ' HB2' HD21 ' A' ' 126' ' ' LEU . 22.9 m-70 -116.38 101.63 8.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.818 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.882 HG22 HD12 ' A' ' 136' ' ' LEU . 3.0 p -97.57 29.24 3.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.046 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -58.5 -43.77 89.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.686 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.574 ' HB3' ' CD1' ' A' ' 38' ' ' ILE . . . -73.09 -27.31 61.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.825 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.882 HD12 HG22 ' A' ' 133' ' ' THR . 13.4 mt -75.97 -46.52 29.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.472 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.69 4.81 20.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.754 179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.72 -35.43 80.1 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.77 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -80.63 -56.17 4.34 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.862 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.1 mp -55.81 -30.77 61.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.827 0.346 . . . . 0.0 111.071 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -33.36 23.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.7 mtt . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.867 0.365 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.62 168.27 11.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.178 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.21 -26.91 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.09 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -63.77 149.86 92.08 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.62 -90.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 122.37 2.047 . . . . 0.0 112.19 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -155.02 148.5 25.21 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.839 0.352 . . . . 0.0 111.168 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.12 -53.34 3.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.06 73.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.926 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.24 -33.87 74.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.453 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.75 -30.47 9.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.005 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 14' ' ' ILE . 32.3 m120 -79.67 -40.32 29.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.03 -34.38 69.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.346 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.75 -41.59 75.04 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.938 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -58.93 -29.24 40.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.967 178.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -70.69 -45.3 65.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.577 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 8.3 mmtt -72.33 -44.35 62.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -63.73 -35.8 74.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.545 179.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -61.45 -47.6 85.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.905 0.383 . . . . 0.0 110.457 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 8.6 ptmt -79.2 -21.08 46.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.04 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.2 -53.59 12.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.718 0.294 . . . . 0.0 110.702 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.674 HG22 HG21 ' A' ' 133' ' ' THR . 20.9 pt -53.06 -43.95 49.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.222 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' N ' HG13 ' A' ' 21' ' ' ILE . 17.1 mmtt -55.19 -43.14 74.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.156 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.5 m -58.49 -40.37 82.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.139 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.51 -39.72 81.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.073 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.407 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.4 mt-10 -58.45 -25.73 62.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.202 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.52 -19.1 30.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.696 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.98 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.98 123.77 28.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.34 130.64 23.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.102 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.404 ' HA3' ' CB ' ' A' ' 33' ' ' SER . . . -110.11 175.61 18.55 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.355 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -113.95 96.91 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.745 0.307 . . . . 0.0 111.432 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.98 31.66 3.79 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.898 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.81 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.2 OUTLIER 75.54 76.16 0.1 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.063 0.458 . . . . 0.0 110.235 -179.569 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.445 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.2 OUTLIER -115.07 30.23 7.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.383 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.464 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -138.78 111.84 7.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.788 0.328 . . . . 0.0 110.37 179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' CB ' ' A' ' 74' ' ' ALA . 16.8 mt -107.96 123.79 63.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.986 0.422 . . . . 0.0 111.305 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.532 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 10.5 t -111.62 121.68 45.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.921 178.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 125' ' ' TYR . 23.4 tp -131.06 128.25 39.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 111.687 -179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.667 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -123.89 123.5 67.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.515 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.406 HG22 ' HB3' ' A' ' 43' ' ' ASP . 10.0 mt -115.21 134.18 22.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.476 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.7 Cg_exo -54.75 156.11 15.85 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.649 2.233 . . . . 0.0 112.542 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.11 -39.11 14.19 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.755 2.303 . . . . 0.0 112.586 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp -79.88 -15.25 57.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.357 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.406 ' HB3' HG22 ' A' ' 39' ' ' ILE . 38.1 t70 -73.44 155.88 38.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.779 0.323 . . . . 0.0 110.661 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.33 147.01 25.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.802 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.84 -54.04 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.514 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.599 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -53.89 -32.38 53.13 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -52.78 -52.9 54.82 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.84 -17.4 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.103 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.599 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -56.85 -33.74 67.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.341 . . . . 0.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.3 mttt -76.52 -46.5 26.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.475 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.449 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.2 OUTLIER -59.63 -45.68 91.26 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.293 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.701 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.72 -55.29 11.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.187 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -30.23 16.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.698 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.74 -40.49 79.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.444 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.45 41.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.657 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.811 ' HB2' HG21 ' A' ' 75' ' ' ILE . 59.6 t80 -63.22 -45.35 92.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.594 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.17 -41.63 31.09 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.327 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -65.51 -32.93 74.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.944 0.402 . . . . 0.0 110.574 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.47 -29.65 66.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.984 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.705 ' OG ' HD11 ' A' ' 72' ' ' LEU . 3.1 m -75.25 -5.48 44.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -102.7 1.62 34.71 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.519 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.2 mt -64.37 141.85 17.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 111.129 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.7 mtmt -65.42 -41.54 93.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.981 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.471 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -74.05 130.57 40.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.892 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.417 ' O ' HD13 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -71.82 -53.72 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.8 t -59.5 -31.68 47.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.503 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.887 ' O ' HG23 ' A' ' 71' ' ' VAL . 15.6 t30 -74.17 -43.14 58.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.322 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.519 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.2 OUTLIER -68.8 -32.93 73.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.138 -179.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.465 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -72.96 -31.57 64.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.883 0.373 . . . . 0.0 110.933 179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.8 t -76.81 -26.14 54.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.261 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.887 HG23 ' O ' ' A' ' 67' ' ' ASN . 27.5 t -81.25 -53.65 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.285 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.705 HD11 ' OG ' ' A' ' 60' ' ' SER . 62.0 mt -53.89 -44.94 70.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.199 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.84 -55.92 27.08 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.632 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.448 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.55 -47.05 83.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 111.228 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' ' 56' ' ' PHE . 71.7 mt -59.22 -41.43 83.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.858 0.361 . . . . 0.0 110.691 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 92.8 m -54.59 -34.35 61.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.608 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.7 m -75.28 -39.28 59.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.709 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.6 t -57.23 -52.62 54.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.007 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -58.31 -37.87 75.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.721 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 5.5 mm100 -61.85 -30.7 71.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.336 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.92 -36.71 25.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.849 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.0 mt -64.79 -37.19 86.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.201 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -65.39 -7.14 12.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.68 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.2 mt -95.3 -8.08 36.92 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.905 0.384 . . . . 0.0 110.366 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.22 113.55 21.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.773 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -71.99 -27.58 62.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.039 0.447 . . . . 0.0 110.604 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.26 168.78 24.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.611 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.822 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.9 t -80.91 132.88 55.95 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-O 120.568 0.223 . . . . 0.0 111.105 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 85.2 Cg_exo -47.06 164.94 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.542 2.162 . . . . 0.0 112.636 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -49.94 -39.22 49.64 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.769 2.313 . . . . 0.0 112.505 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.443 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 9.2 m-20 -89.05 -38.09 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.427 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.67 179.83 31.06 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.584 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.822 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -126.05 119.97 29.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.667 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.2 t -134.37 112.11 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.621 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.658 HG13 ' O ' ' A' ' 112' ' ' ILE . 44.0 t -116.08 147.43 19.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.532 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 18.8 m-30 -128.18 122.3 31.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 110.502 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -131.4 130.48 42.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.12 168.64 40.95 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.692 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.405 ' HB ' ' OG ' ' A' ' 33' ' ' SER . 3.7 m -117.72 112.65 20.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.727 0.299 . . . . 0.0 110.737 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.98 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -110.32 172.06 2.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.137 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.54 147.07 24.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.276 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 52.5 p -104.64 162.24 13.45 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.386 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -51.04 -36.45 39.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -63.78 -14.71 55.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.515 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 95.05 -5.23 68.42 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.411 -0.9 . . . . 0.0 112.88 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -82.73 136.33 34.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.837 0.351 . . . . 0.0 110.88 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -90.97 118.65 30.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.585 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.29 121.43 41.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.23 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.97 140.51 45.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.041 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 20.3 t -116.87 106.98 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.981 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -116.4 110.67 18.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.42 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.21 138.93 52.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.692 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 p30 -137.9 132.0 31.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.243 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.55 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.0 p90 -169.56 170.17 8.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.097 0.475 . . . . 0.0 111.59 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -87.8 136.54 32.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.173 179.15 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.59 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.2 Cg_exo -54.59 164.85 2.77 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.388 2.059 . . . . 0.0 112.674 -179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.938 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 36.0 t80 -61.99 -40.28 95.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.36 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -142.64 164.41 32.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.038 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.655 ' O ' HD13 ' A' ' 120' ' ' ILE . 48.0 Cg_exo -56.31 132.55 52.55 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.102 1.868 . . . . 0.0 112.2 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.655 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.6 mm -128.41 112.45 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.501 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -90.87 44.88 1.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.843 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 8.0 m -153.48 112.14 3.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 0.0 111.502 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.0 OUTLIER -79.81 108.65 13.53 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.924 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.743 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -110.58 137.89 47.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.006 0.431 . . . . 0.0 111.876 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.743 ' N ' HD23 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -130.39 113.43 14.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.977 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.664 HD22 ' CD2' ' A' ' 132' ' ' HIS . 1.5 tt -135.68 128.83 31.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.081 0.467 . . . . 0.0 112.071 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.671 ' SG ' HG22 ' A' ' 32' ' ' THR . 53.1 t -124.79 131.03 53.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.757 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.81 ' HA ' HG23 ' A' ' 32' ' ' THR . 7.8 t0 -166.96 -174.04 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.851 0.358 . . . . 0.0 110.921 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.431 ' C ' ' HG3' ' A' ' 34' ' ' MET . 5.0 m120 -69.8 -3.24 14.75 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.823 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.1 pttp -152.51 144.4 23.68 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.734 0.302 . . . . 0.0 111.182 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 66.1 m-85 -64.21 139.61 58.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.781 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.664 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.7 m-70 -111.99 90.21 3.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.816 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -72.93 65.19 0.73 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.959 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 7.7 mm-40 -73.88 -53.99 8.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.37 -29.95 70.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.038 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 47.5 mt -79.66 -47.43 15.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 61.3 m -75.21 -18.8 60.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.203 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.57 -43.51 80.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.454 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.644 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -58.35 -55.64 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.858 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -60.99 -37.02 81.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.915 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.35 -31.44 63.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.907 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.773 0.321 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.87 12.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.991 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -84.01 -26.71 28.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.548 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.558 ' OD1' ' HB2' ' A' ' 7' ' ' ALA . 3.1 p30 -94.7 150.22 37.63 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.326 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -53.33 -90.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.386 2.058 . . . . 0.0 111.925 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 26.9 p -103.49 99.32 9.14 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.718 0.294 . . . . 0.0 111.283 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.558 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . . . -77.39 -83.88 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.587 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -29.47 70.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 110.644 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.452 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -65.28 -32.84 74.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.556 179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -51.98 -30.46 25.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.084 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.575 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.7 m120 -71.7 -44.11 64.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.445 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.96 -38.87 62.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.551 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -58.41 -34.83 71.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.216 0.532 . . . . 0.0 109.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.867 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.76 -31.96 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.937 178.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.7 t-105 -72.97 -44.98 60.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.328 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.58 -44.53 64.33 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.489 HD12 ' CD1' ' A' ' 117' ' ' PHE . 12.8 mt -59.95 -48.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.174 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -49.72 -45.54 49.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.16 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -79.96 -23.06 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.77 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' A' ' 20' ' ' LEU . 9.2 tp -67.49 -55.47 13.45 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.893 0.378 . . . . 0.0 110.817 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.452 HG13 ' N ' ' A' ' 22' ' ' LYS . 15.9 pt -53.75 -45.31 61.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 21' ' ' ILE . 12.6 mttp -51.31 -47.49 62.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.343 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 m -57.73 -37.04 72.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.962 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.72 -32.04 46.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.139 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 21' ' ' ILE . 2.3 mt-10 -65.28 -35.28 80.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.023 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.48 -19.03 25.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.009 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.967 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -80.6 122.82 27.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.4 mmt-85 -138.91 130.45 27.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.981 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -95.84 178.77 35.13 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.591 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -113.95 99.99 8.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.843 0.354 . . . . 0.0 111.067 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.42 5.13 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.759 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.654 HG22 ' ND2' ' A' ' 129' ' ' ASN . 18.4 p 53.13 56.97 6.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.293 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.0 p -101.68 25.45 8.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 0.0 110.693 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -106.59 124.09 49.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.948 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.45 HD12 ' CB ' ' A' ' 74' ' ' ALA . 72.6 mt -112.99 131.51 64.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.201 0.524 . . . . 0.0 112.19 -178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.543 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.6 OUTLIER -112.55 121.94 46.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.926 178.181 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.784 HD21 HG11 ' A' ' 48' ' ' VAL . 44.4 tp -128.04 117.29 21.4 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -114.21 119.55 61.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.859 178.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.743 HG12 HG21 ' A' ' 48' ' ' VAL . 9.0 mt -113.64 132.08 22.73 Favored Pre-proline 0 C--N 1.331 -0.229 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.611 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.0 Cg_exo -53.87 156.45 12.31 Favored 'Trans proline' 0 C--N 1.348 0.553 0 C-N-CA 122.705 2.27 . . . . 0.0 112.098 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' CD ' ' O ' ' A' ' 120' ' ' ILE . 29.1 Cg_endo -62.85 -39.31 42.53 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.81 2.34 . . . . 0.0 113.018 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.98 -17.15 31.9 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.625 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.17 169.4 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.86 0.362 . . . . 0.0 111.233 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -106.98 125.86 51.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.418 HG23 HD22 ' A' ' 82' ' ' LEU . 14.8 mm -52.12 -23.58 4.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.508 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -79.83 -38.48 32.81 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.037 0.446 . . . . 0.0 110.605 178.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -49.75 -45.84 49.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.133 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.784 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -67.55 -28.26 41.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.508 179.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -60.82 -32.45 71.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.983 0.42 . . . . 0.0 110.16 179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -80.35 -42.95 21.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.168 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.417 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.17 -43.45 98.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.207 179.508 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.039 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -72.16 -57.47 4.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.182 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.05 -29.42 12.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.528 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -59.62 -43.54 93.74 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.326 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.1 -21.68 56.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.746 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.862 ' HB2' HG21 ' A' ' 75' ' ' ILE . 88.6 t80 -65.44 -46.83 78.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.625 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.08 -35.6 84.0 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.172 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.3 m -79.27 -28.65 42.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.852 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.52 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -55.92 -36.42 67.71 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.072 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.563 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -76.52 -5.02 45.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.261 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -100.4 0.85 40.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.24 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.699 HD13 ' OD1' ' A' ' 67' ' ' ASN . 45.2 mt -64.71 143.5 15.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.946 0.403 . . . . 0.0 110.966 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -63.51 -39.85 95.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.964 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.53 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.4 t -72.62 132.62 43.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.888 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -71.87 -56.52 5.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.15 -29.96 47.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 23.7 t-20 -69.22 -50.15 49.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.122 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.6 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.3 OUTLIER -59.13 -34.77 72.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.12 -179.753 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.408 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 24.8 mt -74.79 -32.31 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.135 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -79.76 -32.54 41.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.374 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 41.1 t -69.73 -52.86 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.206 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.563 HD11 ' OG ' ' A' ' 60' ' ' SER . 13.9 mt -57.74 -30.57 65.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.071 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.8 17.41 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.646 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.688 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.78 -42.93 85.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 111.085 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 1.039 HG23 HD12 ' A' ' 52' ' ' LEU . 65.9 mt -60.21 -39.43 80.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.2 m -61.19 -30.63 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.632 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -79.98 -44.48 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.726 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.5 t -52.08 -50.1 36.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.571 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.9 mp0 -60.39 -39.62 87.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.617 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.2 mm100 -58.14 -32.71 68.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.969 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.83 -36.05 32.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.164 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.571 HD11 HG12 ' A' ' 48' ' ' VAL . 62.6 mt -61.23 -38.91 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.501 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -68.58 -4.43 15.31 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.314 179.841 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.427 HD21 ' HE3' ' A' ' 83' ' ' LYS . 7.3 mt -96.91 -13.49 22.4 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.366 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.18 118.72 33.61 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.588 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.92 -30.47 65.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.999 0.428 . . . . 0.0 110.927 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.83 176.94 11.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.997 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.855 HG13 ' HB2' ' A' ' 93' ' ' LEU . 36.9 t -84.46 130.06 55.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 120.486 0.184 . . . . 0.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.416 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 97.1 Cg_exo -44.4 161.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.625 2.217 . . . . 0.0 112.657 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -49.3 -29.38 17.25 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.689 2.259 . . . . 0.0 112.765 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.406 ' HB2' ' CG ' ' A' ' 115' ' ' GLU . 2.3 m-20 -100.11 -37.63 8.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.659 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.413 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.23 173.74 27.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.512 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.855 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -123.83 122.42 37.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.008 0.404 . . . . 0.0 110.817 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.804 HG22 ' HA ' ' A' ' 38' ' ' ILE . 78.6 t -137.08 112.42 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.549 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 112' ' ' ILE . 40.5 t -116.47 150.52 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.501 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -131.79 135.42 46.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.967 0.413 . . . . 0.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.2 m -142.16 130.69 22.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.754 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.51 40.97 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.504 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 63.0 m -112.81 119.04 36.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.774 0.321 . . . . 0.0 110.721 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.967 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -110.17 160.36 9.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.978 0.418 . . . . 0.0 111.295 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.701 HG22 ' HG3' ' A' ' 107' ' ' GLU . 17.9 t -117.72 143.99 26.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.184 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 71.4 p -104.59 161.62 13.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.472 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.32 -34.05 31.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.069 0.462 . . . . 0.0 110.551 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -14.57 59.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.523 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.89 24.89 28.67 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.419 -0.896 . . . . 0.0 112.556 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -110.52 136.23 49.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.015 0.436 . . . . 0.0 110.97 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.701 ' HG3' HG22 ' A' ' 101' ' ' VAL . 2.9 mp0 -91.91 118.7 30.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtpp -117.21 121.72 41.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.111 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -73.73 140.42 45.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.2 t -122.03 107.03 18.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.019 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -115.42 110.59 19.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.296 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.621 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.59 141.3 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.779 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -135.25 132.51 37.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.975 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -169.51 170.12 8.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.49 . . . . 0.0 111.818 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.409 ' HG3' ' HB2' ' A' ' 89' ' ' PRO . 27.8 tt0 -95.41 142.2 24.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.258 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.481 ' CB ' HD11 ' A' ' 120' ' ' ILE . 31.3 Cg_endo -63.87 168.15 12.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.416 2.077 . . . . 0.0 112.403 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.867 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -65.9 -37.6 86.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.948 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -135.08 170.46 11.15 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.817 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 31.7 Cg_exo -58.78 141.62 98.04 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.503 2.135 . . . . 0.0 112.468 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.675 HG22 ' H ' ' A' ' 122' ' ' THR . 14.2 mm -101.1 153.51 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -138.94 17.01 2.65 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.746 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.675 ' H ' HG22 ' A' ' 120' ' ' ILE . 1.8 m -156.69 111.99 2.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.527 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -76.4 114.25 14.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.751 0.31 . . . . 0.0 110.472 179.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.656 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.6 tt -114.95 130.89 57.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.01 0.434 . . . . 0.0 112.014 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.656 ' N ' HD23 ' A' ' 124' ' ' LEU . 51.3 t80 -130.5 121.25 25.44 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.16 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.634 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.22 32.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.536 0.684 . . . . 0.0 112.358 -179.223 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 12.9 t -124.86 130.57 52.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.762 -1.108 . . . . 0.0 110.039 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.59 -170.72 3.53 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.001 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.654 ' ND2' HG22 ' A' ' 32' ' ' THR . 72.5 m-80 -81.03 5.05 17.63 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.476 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.97 152.3 19.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.673 0.273 . . . . 0.0 110.443 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 74.5 m-85 -70.14 125.13 25.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.798 0.332 . . . . 0.0 110.419 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.488 ' HB2' HD21 ' A' ' 126' ' ' LEU . 5.5 m-70 -86.7 97.69 10.72 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.834 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.041 HG22 HD12 ' A' ' 136' ' ' LEU . 1.3 p -92.74 24.79 3.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.884 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.602 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.1 pp20? -54.06 -51.21 64.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.4 -25.95 68.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.171 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.041 HD12 HG22 ' A' ' 133' ' ' THR . 62.1 mt -79.77 -48.98 12.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.938 0.399 . . . . 0.0 110.885 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.1 m -81.61 -13.97 57.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.257 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -65.08 -37.4 87.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.425 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.692 HD11 ' HD2' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.63 -51.62 68.64 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.775 -179.51 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.66 ' N ' ' HG ' ' A' ' 139' ' ' LEU . 9.8 mp -56.76 -40.67 76.23 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.79 0.329 . . . . 0.0 110.977 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -31.34 60.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.91 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.888 -179.942 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.476 ' HB1' ' OD2' ' A' ' 4' ' ' ASP . . . -70.93 135.96 48.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -86.06 -10.5 54.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.346 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.476 ' OD2' ' HB1' ' A' ' 2' ' ' ALA . 2.0 p30 -55.54 141.46 63.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.025 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.33 -38.83 93.5 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.463 2.109 . . . . 0.0 112.441 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.8 p -178.6 37.01 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.001 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.85 -81.97 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.232 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.15 -29.24 70.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.985 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -32.57 73.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.675 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 12.7 ptt180 -52.12 -30.69 27.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.118 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.635 ' O ' HG22 ' A' ' 14' ' ' ILE . 23.3 m120 -73.05 -43.47 61.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.2 t -64.32 -34.47 69.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.234 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.448 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.6 mm-40 -70.06 -39.42 75.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.678 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.48 -30.49 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.793 178.737 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -70.14 -48.28 58.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.599 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.08 -46.66 67.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.816 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -57.17 -37.51 56.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.63 179.625 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 5.6 ttmm -60.38 -50.02 75.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.436 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -78.43 -21.1 49.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -75.12 -50.56 15.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.173 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.699 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.6 pp -56.58 -47.84 81.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.443 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.699 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.5 OUTLIER -56.08 -45.36 79.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.819 0.343 . . . . 0.0 111.306 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -58.06 -32.27 67.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.67 -37.79 41.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.177 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -62.16 -26.71 68.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.116 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.41 -14.86 39.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.199 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.6 127.32 33.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.876 0.369 . . . . 0.0 111.153 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.52 131.46 29.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.946 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.79 172.58 20.18 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.382 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -113.83 91.59 3.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.635 0.255 . . . . 0.0 111.433 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.81 31.58 3.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.713 179.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.884 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 73.44 68.24 0.11 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.147 0.499 . . . . 0.0 110.482 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' ' 99' ' ' THR . 2.5 m -110.89 33.07 4.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.756 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.16 112.51 9.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.995 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.702 HG21 HG21 ' A' ' 78' ' ' VAL . 22.3 mt -108.11 123.54 63.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.139 0.495 . . . . 0.0 111.5 -179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.516 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 26.9 t -111.43 122.24 47.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.665 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 13.3 tp -131.72 127.69 37.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.083 0.468 . . . . 0.0 111.783 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.9 mp -124.2 124.17 68.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.452 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.714 HG12 HG21 ' A' ' 48' ' ' VAL . 16.8 mt -116.01 138.03 23.8 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.557 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.624 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -59.4 156.23 37.03 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.662 2.241 . . . . 0.0 112.576 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.81 -39.11 27.14 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.82 2.347 . . . . 0.0 112.552 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HD2' ' HB2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -84.14 -16.08 44.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.318 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.96 167.4 13.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.381 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -111.56 145.45 39.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.855 0.359 . . . . 0.0 110.843 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.792 HG23 HD22 ' A' ' 82' ' ' LEU . 31.9 mm -57.97 -53.76 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.401 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.602 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.1 t -55.8 -28.05 54.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.771 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 12.1 ttt-85 -56.55 -56.76 17.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.582 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.714 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -56.57 -22.97 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.046 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -49.27 -30.1 6.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.245 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.18 -43.25 24.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.797 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.1 OUTLIER -63.54 -44.68 93.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.324 179.65 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.93 -55.46 9.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.43 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.25 -31.25 20.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.732 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -63.97 -39.65 94.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.474 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.82 -24.34 33.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.835 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.805 ' HB2' HG21 ' A' ' 75' ' ' ILE . 91.3 t80 -65.5 -42.99 91.52 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.652 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.22 -43.89 54.5 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.372 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.75 -29.51 69.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.814 0.34 . . . . 0.0 110.736 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.479 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -60.7 -30.98 70.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.005 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.593 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -78.5 -3.19 42.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.35 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -104.62 2.25 30.42 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.497 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.664 HD12 ' HA ' ' A' ' 68' ' ' ARG . 67.2 mt -64.67 143.43 15.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.901 0.381 . . . . 0.0 110.953 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.05 -41.97 97.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.282 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.469 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.17 131.18 39.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.049 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -46.12 59.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.28 -35.29 75.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.314 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.82 ' O ' HG23 ' A' ' 71' ' ' VAL . 4.7 t-20 -72.69 -46.17 55.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.971 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.664 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -60.73 -33.0 72.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.481 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 15.6 mt -74.72 -39.7 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.887 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -66.35 -30.4 70.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.8 t -76.7 -53.7 14.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.593 HD11 ' OG ' ' A' ' 60' ' ' SER . 61.5 mt -58.41 -38.42 77.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.913 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.61 63.81 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.377 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.609 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -63.45 -46.02 88.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.34 . . . . 0.0 110.896 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 98.1 mt -58.97 -41.41 83.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.704 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.2 m -58.84 -30.69 67.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.635 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 67.1 m -79.36 -42.54 25.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.665 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.702 HG21 HG21 ' A' ' 35' ' ' ILE . 46.1 t -53.03 -52.62 27.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.713 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.455 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 4.6 mt-30 -61.48 -42.02 98.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.403 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -30.93 14.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.553 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.469 ' NH1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -79.87 -30.74 40.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.634 179.536 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.792 HD22 HG23 ' A' ' 45' ' ' ILE . 47.1 mt -64.12 -37.23 86.71 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.47 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.44 -12.33 56.62 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.482 179.21 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.469 HD11 ' NH1' ' A' ' 81' ' ' ARG . 2.5 mt -96.77 -14.03 22.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.293 178.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -116.35 113.75 23.36 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.312 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -71.86 -25.93 62.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttp -157.87 170.94 21.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.82 HG13 ' HB2' ' A' ' 93' ' ' LEU . 96.6 t -83.07 129.17 62.29 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.56 0.219 . . . . 0.0 111.058 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.465 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.1 Cg_exo -43.96 164.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.708 2.272 . . . . 0.0 112.896 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.72 -40.05 47.34 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.873 2.382 . . . . 0.0 112.817 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.4 m-20 -87.75 -40.79 13.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.577 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.31 174.56 28.18 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.486 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.82 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -122.44 120.31 33.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.924 0.392 . . . . 0.0 110.802 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.579 HG22 ' HA ' ' A' ' 38' ' ' ILE . 90.2 t -135.35 112.23 13.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.746 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 112' ' ' ILE . 34.7 t -117.01 148.88 19.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.516 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 20.7 m-30 -130.0 118.5 21.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.035 0.445 . . . . 0.0 110.88 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.7 m -127.8 130.02 47.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.402 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.46 168.62 41.09 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.872 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 33' ' ' SER . 53.9 m -120.24 118.34 30.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.333 . . . . 0.0 110.68 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.8 pp -110.1 170.24 3.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.291 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.2 t -117.1 143.83 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.581 HG23 ' HG3' ' A' ' 108' ' ' LYS . 73.3 p -104.6 161.06 14.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.639 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -54.32 -30.03 49.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.022 0.439 . . . . 0.0 110.514 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.07 -14.5 62.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.394 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.22 -5.31 71.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.832 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -82.26 134.23 35.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.868 0.366 . . . . 0.0 110.693 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.9 mp0 -78.05 134.0 37.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.987 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.581 ' HG3' HG23 ' A' ' 102' ' ' THR . 14.0 mtpt -119.7 154.13 34.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.753 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -122.7 130.09 52.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.578 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 23.3 t -113.72 107.06 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.314 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -116.75 110.55 18.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.176 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.63 141.19 46.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.772 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -131.63 135.88 47.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.0 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.734 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.0 p90 -169.49 170.44 8.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.111 0.481 . . . . 0.0 111.833 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.465 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 0.0 OUTLIER -99.7 142.49 24.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.234 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' VAL . 42.4 Cg_exo -54.8 161.19 6.46 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.245 1.963 . . . . 0.0 112.518 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.678 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -59.5 -35.68 74.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.48 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HD3' ' HD2' ' A' ' 119' ' ' PRO . 14.1 mmtm -145.91 162.98 33.38 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.005 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.721 ' O ' HD13 ' A' ' 120' ' ' ILE . 9.5 Cg_endo -53.31 132.48 48.48 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.14 1.894 . . . . 0.0 112.096 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.721 HD13 ' O ' ' A' ' 119' ' ' PRO . 20.6 mm -128.53 112.8 27.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.444 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -88.23 45.38 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.712 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.9 m -154.38 112.22 3.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.74 0.305 . . . . 0.0 111.444 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -80.81 110.12 16.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.794 HD23 ' N ' ' A' ' 125' ' ' TYR . 3.6 tt -110.78 132.05 54.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.0 111.654 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.794 ' N ' HD23 ' A' ' 124' ' ' LEU . 35.7 t80 -130.24 116.19 18.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.962 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.699 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.8 OUTLIER -139.04 133.76 32.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 112.31 -178.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.637 ' SG ' HG22 ' A' ' 32' ' ' THR . 36.3 t -124.52 130.73 53.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.668 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.884 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -164.87 -168.68 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.911 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.421 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.9 m120 -75.02 -1.75 24.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.821 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.8 pttm -154.67 145.43 22.43 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.87 0.367 . . . . 0.0 111.21 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 76.3 m-85 -65.83 133.28 50.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.71 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.699 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.4 m-70 -103.37 99.67 9.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.668 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.885 HG22 HD12 ' A' ' 136' ' ' LEU . 0.6 OUTLIER -93.77 37.42 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.228 -179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.577 ' HA ' HG22 ' A' ' 137' ' ' THR . 0.0 OUTLIER -59.96 -34.09 72.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.611 179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.15 -32.51 66.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.619 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.885 HD12 HG22 ' A' ' 133' ' ' THR . 44.0 mt -77.8 -47.79 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.577 HG22 ' HA ' ' A' ' 134' ' ' GLU . 13.6 t -66.03 -16.14 63.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.882 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -53.54 -49.8 66.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.673 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.643 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -58.87 -56.94 15.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 110.763 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 8.9 mp -56.37 -30.94 63.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.034 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 93.9 p -82.03 -32.65 30.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.957 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptp . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.01 168.83 19.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.091 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.97 -17.71 39.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.115 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.494 ' CG ' ' HD2' ' A' ' 5' ' ' PRO . 10.0 t70 -54.13 144.76 37.78 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.648 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CG ' ' A' ' 4' ' ' ASP . 9.5 Cg_endo -49.14 -85.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.53 0.277 0 C-N-CA 122.801 2.334 . . . . 0.0 112.109 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.411 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 78.0 p -96.93 120.06 36.57 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.863 0.364 . . . . 0.0 111.09 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.2 -82.55 0.44 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.956 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.54 -26.29 20.57 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.13 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.3 OUTLIER -59.39 -38.0 79.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.71 179.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -46.32 -41.7 13.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.037 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.577 ' O ' HG22 ' A' ' 14' ' ' ILE . 15.2 m120 -67.9 -42.9 80.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.052 0.454 . . . . 0.0 110.153 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 36.6 t -58.24 -37.58 63.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.387 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' ILE . 4.5 mt-10 -61.24 -35.06 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.524 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.727 HD12 ' HZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -65.4 -30.58 50.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.875 178.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -72.77 -49.84 28.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.603 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.868 ' HD3' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -68.04 -43.94 77.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.347 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.576 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -60.52 -38.91 79.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.328 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -60.03 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -79.55 -21.06 45.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.105 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.868 HD12 ' HD3' ' A' ' 16' ' ' LYS . 10.0 mt -75.16 -51.12 14.18 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.121 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 17' ' ' ILE . 11.7 pt -53.48 -49.83 52.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.23 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -52.04 -42.67 63.28 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.09 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 m -60.4 -35.31 75.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 21' ' ' ILE . 9.1 mt -78.61 -37.17 42.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.36 -31.16 71.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.3 -12.75 34.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.348 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.931 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -86.94 125.74 34.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.049 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.63 135.91 20.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.034 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -114.29 176.08 16.72 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.365 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -114.04 100.54 8.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.713 0.292 . . . . 0.0 111.607 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 106.59 31.68 3.89 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.887 179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 128' ' ' ASP . 0.3 OUTLIER 74.16 69.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.142 0.496 . . . . 0.0 110.204 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.415 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -108.49 31.15 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.724 -179.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.461 ' CE ' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -137.44 112.63 9.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.373 -179.927 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.617 HD12 ' CB ' ' A' ' 74' ' ' ALA . 10.6 mt -108.34 120.23 59.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.129 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.481 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -107.87 123.33 48.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.79 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 48' ' ' VAL . 12.0 tp -130.06 125.48 35.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.537 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.604 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.3 mp -123.91 124.48 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.398 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.814 HG12 HG21 ' A' ' 48' ' ' VAL . 14.9 mt -118.04 137.84 24.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.614 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.598 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.4 Cg_exo -58.72 156.07 34.33 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.697 2.265 . . . . 0.0 112.31 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.87 -39.32 33.88 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.632 2.221 . . . . 0.0 112.54 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.78 -16.81 49.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.946 0.403 . . . . 0.0 111.41 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.29 163.85 19.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.418 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -108.79 146.4 33.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.824 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.754 HG23 HD22 ' A' ' 82' ' ' LEU . 22.4 mm -57.48 -53.91 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.536 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.632 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -55.73 -30.76 61.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 110.919 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -54.38 -56.3 20.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.521 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.814 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -57.73 -23.62 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.964 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.52 -30.27 29.57 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.837 0.351 . . . . 0.0 110.987 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -52.72 9.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.718 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -44.14 86.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.622 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.917 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.86 -57.2 5.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.581 179.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.24 -32.94 25.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.6 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -61.28 -37.88 84.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.228 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -82.88 -23.82 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.783 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.822 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.2 -41.55 90.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.16 -41.72 92.03 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.138 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 m -71.03 -27.88 63.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.647 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 68' ' ' ARG . . . -61.26 -32.75 72.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.78 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.524 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -80.03 3.93 18.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.32 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -115.08 3.38 14.4 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.813 HD12 ' HA ' ' A' ' 68' ' ' ARG . 25.7 mt -65.04 143.93 15.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.973 0.416 . . . . 0.0 111.009 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -43.3 99.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.331 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.436 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -73.99 133.39 42.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.887 0.375 . . . . 0.0 110.82 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.439 ' O ' HD13 ' A' ' 69' ' ' LEU . 13.2 tpt180 -70.54 -50.07 41.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.41 -32.7 55.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.43 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.9 ' O ' HG23 ' A' ' 71' ' ' VAL . 6.7 t30 -73.72 -50.85 18.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.025 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.813 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -56.39 -39.15 72.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.89 0.376 . . . . 0.0 110.729 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 65' ' ' ARG . 9.4 mp -74.61 -35.5 62.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.669 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.0 t -69.81 -31.18 68.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.851 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.9 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.1 t -77.11 -52.48 16.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.448 HD11 ' OG ' ' A' ' 60' ' ' SER . 43.8 mt -56.26 -37.74 70.19 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.43 -48.71 80.18 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.659 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.617 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -65.38 -46.28 80.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.713 0.292 . . . . 0.0 111.127 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.917 HG23 HD12 ' A' ' 52' ' ' LEU . 66.6 mt -59.62 -40.22 81.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.818 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.1 m -60.21 -31.26 70.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.772 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.401 ' HG ' ' HZ3' ' A' ' 109' ' ' LYS . 33.1 m -78.7 -40.29 34.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 74' ' ' ALA . 41.4 t -54.39 -49.86 61.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.835 0.35 . . . . 0.0 110.785 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.2 -34.91 79.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.696 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.481 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 14.6 mm-40 -58.03 -32.47 67.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.428 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.58 -31.29 36.84 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.516 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.754 HD22 HG23 ' A' ' 45' ' ' ILE . 56.3 mt -62.61 -36.18 81.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.571 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.508 ' HE3' HD21 ' A' ' 84' ' ' LEU . 1.2 pttp -66.85 -9.96 43.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.047 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.508 HD21 ' HE3' ' A' ' 83' ' ' LYS . 2.7 mt -98.49 -16.97 18.98 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.882 0.373 . . . . 0.0 110.305 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.76 111.76 22.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.453 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -71.88 -26.14 62.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.871 0.367 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -155.9 169.8 23.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.873 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.1 t -80.9 132.15 58.05 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.504 0.192 . . . . 0.0 111.176 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 86.4 Cg_exo -46.16 164.96 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.663 2.242 . . . . 0.0 112.624 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.55 -39.12 55.65 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 6.9 m-20 -88.01 -41.43 13.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.35 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 159.53 176.01 31.12 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.471 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -121.91 119.46 31.61 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.867 0.365 . . . . 0.0 110.833 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.604 HG22 ' HA ' ' A' ' 38' ' ' ILE . 89.2 t -136.12 112.19 12.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.719 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.67 HG13 ' O ' ' A' ' 112' ' ' ILE . 58.8 t -116.97 149.36 19.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.509 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.93 119.9 23.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 110.725 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 86.6 m -130.52 131.39 45.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.844 -179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.41 164.25 37.86 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.794 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 m -107.11 113.69 27.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.646 0.26 . . . . 0.0 110.319 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.931 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -115.65 172.03 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.956 0.408 . . . . 0.0 111.588 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.9 t -120.29 147.16 24.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.276 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.0 p -104.58 161.54 14.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.381 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.4 -37.71 39.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.036 0.446 . . . . 0.0 110.575 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.66 -14.59 53.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.564 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.52 65.57 Favored Glycine 0 C--N 1.334 0.452 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.707 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -92.0 134.23 35.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.79 0.329 . . . . 0.0 110.616 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -84.26 118.37 24.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.686 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.422 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -126.33 121.47 32.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.737 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.439 ' HZ1' ' HA ' ' A' ' 74' ' ' ALA . 2.6 mtpt -75.46 140.47 42.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.371 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.4 t -111.76 106.96 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.74 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -117.61 110.51 18.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.67 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.42 140.41 49.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.268 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.498 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.0 p-10 -136.69 131.53 33.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.303 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 20' ' ' LEU . 11.2 p90 -170.16 170.33 7.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.024 0.44 . . . . 0.0 111.429 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.2 pt-20 -92.14 144.93 29.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.122 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.87 168.04 9.4 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.396 2.064 . . . . 0.0 112.373 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 14' ' ' ILE . 1.6 t80 -61.75 -37.77 85.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.16 164.36 37.9 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.458 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.432 ' O ' HD13 ' A' ' 120' ' ' ILE . 25.4 Cg_endo -62.21 132.65 39.81 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.064 1.842 . . . . 0.0 112.305 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.432 HD13 ' O ' ' A' ' 119' ' ' PRO . 25.0 mm -128.49 112.89 27.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.318 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -86.73 47.46 1.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.794 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.2 m -153.68 111.97 3.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.731 0.3 . . . . 0.0 111.231 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -81.17 110.33 16.56 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.25 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.06 125.4 53.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.438 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 58.6 t80 -130.2 123.24 29.74 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.293 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.65 152.08 33.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.488 0.661 . . . . 0.0 112.249 -179.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.55 ' SG ' HG22 ' A' ' 32' ' ' THR . 6.7 t -125.04 129.51 50.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.796 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.822 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.4 t70 -156.47 -175.82 5.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.949 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.405 ' C ' ' HG3' ' A' ' 34' ' ' MET . 22.9 m-80 -76.36 0.51 19.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.781 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -155.9 146.63 22.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.804 0.335 . . . . 0.0 111.048 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.509 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 72.8 m-85 -65.7 131.66 46.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.673 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 17.9 m-70 -99.65 93.13 5.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.858 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.904 HG22 HD12 ' A' ' 136' ' ' LEU . 1.0 OUTLIER -91.69 49.32 1.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.92 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -67.22 -40.49 86.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.853 179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.54 -29.38 59.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.142 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.904 HD12 HG22 ' A' ' 133' ' ' THR . 36.1 mt -79.04 -47.57 15.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -79.69 -3.74 48.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -66.96 -39.16 87.16 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.216 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.64 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.1 OUTLIER -61.61 -56.78 16.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.858 0.361 . . . . 0.0 110.588 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.8 mm? -62.16 -40.66 96.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.96 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.6 t -70.42 -31.32 68.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.6 t70 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.881 179.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.13 168.3 2.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.018 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -109.79 -26.82 9.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.449 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 12.9 t70 -60.48 150.35 74.22 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.801 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.8 Cg_endo -80.77 -77.7 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.094 2.53 . . . . 0.0 112.295 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 p -156.21 150.48 25.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 111.225 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.28 -52.91 3.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.918 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.85 -28.26 69.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.04 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.525 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.5 mtt85 -51.69 -30.43 21.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.98 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.613 ' O ' HG22 ' A' ' 14' ' ' ILE . 30.2 m120 -74.22 -42.92 58.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.346 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.4 t -58.71 -37.45 65.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.407 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -59.4 -39.65 84.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -59.9 -31.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.043 178.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.8 t-105 -75.29 -44.72 44.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.865 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.82 -45.05 60.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.046 0.45 . . . . 0.0 109.999 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.403 ' O ' HG23 ' A' ' 21' ' ' ILE . 0.9 OUTLIER -62.91 -37.24 78.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.519 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 3.6 ttpt -60.34 -41.79 94.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 18.4 mtpt -79.69 -33.99 40.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.035 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -51.14 63.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.243 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.7 pp -54.86 -46.55 75.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.455 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.711 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -53.81 -44.7 70.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.771 0.319 . . . . 0.0 111.351 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.5 p -65.66 -28.25 68.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.335 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.64 -26.74 45.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.54 -21.66 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.401 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -87.26 -15.22 38.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.146 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.43 122.64 28.77 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.21 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.15 130.71 27.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.877 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -104.74 176.13 22.83 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.687 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.82 100.9 8.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.825 0.345 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.98 24.92 6.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.691 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.53 HG22 ' CG ' ' A' ' 129' ' ' ASN . 60.4 p 50.06 63.54 2.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.779 0.323 . . . . 0.0 111.443 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.0 t -104.24 24.02 12.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.992 0.425 . . . . 0.0 110.686 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.447 ' HE1' HG23 ' A' ' 100' ' ' ILE . 0.2 OUTLIER -104.41 129.09 52.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.838 179.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.458 HD12 ' CB ' ' A' ' 74' ' ' ALA . 98.5 mt -114.66 129.06 71.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.203 0.525 . . . . 0.0 112.088 -179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -110.08 124.2 51.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.369 -0.832 . . . . 0.0 108.926 178.263 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.692 HD21 HG11 ' A' ' 48' ' ' VAL . 60.0 tp -129.67 121.26 26.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 112.035 -178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.86 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.6 mp -118.34 121.99 68.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.767 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.689 ' CD1' HG21 ' A' ' 48' ' ' VAL . 10.4 mt -116.13 133.1 22.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.6 ' O ' HG11 ' A' ' 88' ' ' VAL . 52.5 Cg_exo -55.04 156.2 16.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.665 2.243 . . . . 0.0 112.306 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -63.8 -39.48 33.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.707 2.271 . . . . 0.0 112.968 -179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.55 -16.07 52.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 111.506 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.443 ' HB3' HG22 ' A' ' 39' ' ' ILE . 0.3 OUTLIER -66.74 158.32 30.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.287 . . . . 0.0 110.856 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 147.5 26.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.646 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.46 -53.98 36.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.49 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 6.1 t -55.49 -30.09 59.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.795 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -55.01 28.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.578 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.692 HG11 HD21 ' A' ' 37' ' ' LEU . 0.9 OUTLIER -54.23 -27.74 17.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.783 179.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.8 -30.66 34.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -76.4 -45.85 29.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.373 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.411 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.21 -43.83 97.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.231 179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.888 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.7 OUTLIER -66.32 -47.12 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.221 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.31 -29.91 16.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.688 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -70.52 -49.96 42.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.607 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -29.47 65.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.755 ' HB2' HG21 ' A' ' 75' ' ' ILE . 90.8 t80 -66.58 -44.24 82.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.037 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.74 74.16 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.236 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.9 m -65.3 -28.21 69.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 0.0 110.503 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.603 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -64.88 -34.18 77.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.527 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.8 m -78.07 4.93 11.08 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.452 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -115.42 3.15 14.07 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 68' ' ' ARG . 57.6 mt -65.24 143.82 15.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -62.95 -43.07 99.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.364 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.452 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.8 t -74.97 127.74 33.93 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.901 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -64.9 -44.27 90.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.86 -36.85 77.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.464 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.784 HD22 HD13 ' A' ' 62' ' ' ILE . 5.4 t30 -71.38 -46.38 60.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.069 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.816 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -56.37 -43.69 79.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.575 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.686 HD22 ' HD3' ' A' ' 68' ' ' ARG . 3.5 mm? -74.51 -31.99 62.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.731 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.9 t -65.81 -33.07 75.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.761 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 67' ' ' ASN . 21.4 t -79.96 -48.83 19.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.428 HD11 ' OG ' ' A' ' 60' ' ' SER . 30.9 mt -57.56 -34.77 69.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.769 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.38 -49.33 71.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.617 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -65.51 -48.39 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.778 0.323 . . . . 0.0 110.964 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.888 HG23 ' CD1' ' A' ' 52' ' ' LEU . 61.3 mt -57.22 -43.57 82.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 98.9 m -58.35 -28.76 65.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.529 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.6 m -79.92 -39.96 29.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.834 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.84 ' HB ' HD21 ' A' ' 52' ' ' LEU . 41.0 t -53.26 -58.0 3.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.115 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 52' ' ' LEU . 4.0 mt-30 -59.01 -35.17 72.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.935 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.5 mm-40 -56.8 -32.51 65.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.963 0.411 . . . . 0.0 109.986 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.505 ' CB ' HG11 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -76.88 -31.24 56.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.084 178.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.1 mt -63.91 -33.79 76.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.09 179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -63.92 -11.58 29.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.892 179.362 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.423 HD21 ' HE3' ' A' ' 83' ' ' LYS . 3.6 mt -96.45 -14.32 22.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.888 0.375 . . . . 0.0 110.492 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -118.64 117.55 29.26 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.591 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -71.94 -45.63 60.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.567 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -133.09 170.77 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.849 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.802 HG13 ' HB2' ' A' ' 93' ' ' LEU . 57.3 t -80.53 132.11 59.44 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.614 0.245 . . . . 0.0 111.057 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' HG2' ' HB3' ' A' ' 115' ' ' GLU . 88.7 Cg_exo -45.44 164.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.727 2.285 . . . . 0.0 112.717 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -50.73 -38.16 55.72 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.655 2.237 . . . . 0.0 112.521 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -91.03 -37.51 13.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.478 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.41 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.66 176.78 30.11 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.311 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.802 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -122.29 120.05 32.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.936 0.368 . . . . 0.0 110.58 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.86 HG22 ' HA ' ' A' ' 38' ' ' ILE . 83.9 t -135.52 111.99 13.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.612 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 112' ' ' ILE . 53.3 t -118.0 150.52 20.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.503 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.8 m-30 -129.7 129.79 44.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.884 0.373 . . . . 0.0 111.067 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.438 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 66.3 m -139.2 129.27 25.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.701 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.39 168.54 41.0 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.552 -0.833 . . . . 0.0 112.638 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 92.8 m -112.16 121.61 45.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.64 0.257 . . . . 0.0 110.599 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.583 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -121.17 169.87 11.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.913 0.387 . . . . 0.0 111.366 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.6 t -121.22 148.32 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.38 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 46.7 p -104.71 162.34 13.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.299 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -35.65 42.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.026 0.441 . . . . 0.0 110.392 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -64.67 -14.65 59.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.46 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.59 18.61 51.54 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.725 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -102.85 134.51 46.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.802 0.334 . . . . 0.0 110.747 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.56 118.48 26.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.435 ' O ' HG13 ' A' ' 100' ' ' ILE . 1.7 mtpt -124.28 121.59 35.43 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.591 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.17 140.4 41.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.128 0.489 . . . . 0.0 111.438 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 28.6 t -110.24 106.96 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.809 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -117.65 110.53 18.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.585 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.68 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -131.95 141.99 44.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.502 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -135.24 131.8 37.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.333 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.459 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 48.0 p90 -169.86 170.21 7.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.038 0.447 . . . . 0.0 111.518 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.423 ' HB3' ' HG2' ' A' ' 89' ' ' PRO . 13.4 pt-20 -95.17 141.48 23.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.224 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.445 ' HD3' HG23 ' A' ' 94' ' ' VAL . 19.5 Cg_endo -58.3 168.07 4.14 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.366 2.044 . . . . 0.0 112.258 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.533 ' CE2' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -65.28 -38.09 89.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.078 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.06 163.28 48.84 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.553 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 120' ' ' ILE . 24.8 Cg_endo -61.9 132.61 40.45 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.233 1.955 . . . . 0.0 112.183 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 119' ' ' PRO . 26.2 mm -128.28 113.02 28.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.25 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 48.1 m-20 -87.27 46.11 1.34 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 39.2 m -154.95 112.06 3.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.116 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.485 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.7 OUTLIER -82.48 112.78 19.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.131 -179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.683 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.5 tt -114.79 128.34 56.25 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.798 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.684 ' HD2' HD13 ' A' ' 37' ' ' LEU . 11.2 t80 -130.41 123.5 29.99 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.566 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.73 152.46 32.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.34 0.59 . . . . 0.0 112.104 -178.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 34' ' ' MET . 33.7 t -122.41 128.62 51.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.516 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -150.83 -164.92 2.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.69 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.53 ' CG ' HG22 ' A' ' 32' ' ' THR . 72.3 m-80 -84.96 9.21 15.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.409 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.93 161.84 7.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.733 0.302 . . . . 0.0 110.321 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.503 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 27.8 m-85 -74.25 125.17 27.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.854 0.359 . . . . 0.0 110.465 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -86.4 95.58 9.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.879 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.691 HG22 HD12 ' A' ' 136' ' ' LEU . 19.4 p -79.8 59.2 3.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.961 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.6 mt-10 -73.75 -52.09 14.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.579 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.38 63.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.077 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.691 HD12 HG22 ' A' ' 133' ' ' THR . 73.4 mt -79.75 -50.68 10.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 11.2 m -74.9 -12.23 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.883 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.681 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -61.74 -40.89 96.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.273 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.594 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.2 OUTLIER -60.6 -56.93 15.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.777 0.322 . . . . 0.0 110.632 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.43 -32.3 64.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.017 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 18.2 t -80.56 -31.41 36.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.914 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.875 0.369 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.5 168.38 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -88.49 8.43 28.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.337 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -69.64 149.98 96.81 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.719 0.295 . . . . 0.0 110.917 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.5 -6.4 18.88 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.596 2.197 . . . . 0.0 112.762 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.6 p 172.91 75.16 0.0 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.018 0.437 . . . . 0.0 110.941 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.02 -85.6 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.521 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.55 -27.48 68.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -34.4 74.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 3.4 ttp180 -51.26 -30.68 18.53 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.249 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.497 ' O ' HG22 ' A' ' 14' ' ' ILE . 29.9 m120 -78.03 -41.17 36.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.934 0.397 . . . . 0.0 110.368 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.7 t -56.36 -41.19 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.716 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.783 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.8 mm-40 -61.19 -38.61 87.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.127 0.489 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.931 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.4 -32.27 55.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.947 178.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -69.79 -41.73 74.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.522 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mmtt -77.3 -43.62 32.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.256 0.55 . . . . 0.0 109.604 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.783 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.7 mt -61.9 -35.12 66.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.224 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -63.99 -44.59 92.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 0.0 109.992 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 25.9 mtpt -77.57 -27.18 51.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.682 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.46 HD21 HG21 ' A' ' 112' ' ' ILE . 5.2 mt -70.48 -49.96 42.99 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.18 -179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.415 HG13 ' N ' ' A' ' 22' ' ' LYS . 9.9 pt -54.72 -50.04 63.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.211 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' N ' HG13 ' A' ' 21' ' ' ILE . 3.6 mptp? -51.26 -44.52 61.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.395 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.9 -38.13 72.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.813 HD22 ' CD2' ' A' ' 131' ' ' PHE . 31.4 mt -78.69 -35.15 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.209 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.52 -34.85 73.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.265 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -89.51 -20.8 23.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.92 123.22 28.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.571 ' C ' HG22 ' A' ' 100' ' ' ILE . 0.4 OUTLIER -142.6 130.48 21.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.81 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.44 ' N ' HG22 ' A' ' 100' ' ' ILE . . . -102.81 176.79 25.16 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.671 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.91 104.56 12.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.852 0.358 . . . . 0.0 111.016 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.93 29.71 4.24 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.719 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.436 HG22 ' OD1' ' A' ' 129' ' ' ASN . 37.7 p 48.98 58.8 4.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.724 0.297 . . . . 0.0 111.269 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.48 27.76 5.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.073 0.463 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.427 ' CE ' HG23 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -107.91 122.87 47.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.776 179.951 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.661 HG23 ' HE1' ' A' ' 125' ' ' TYR . 28.8 mt -111.42 122.04 65.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.167 0.508 . . . . 0.0 111.901 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.503 ' HB3' HD23 ' A' ' 126' ' ' LEU . 1.4 t -107.38 123.26 48.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.651 ' C ' HD12 ' A' ' 38' ' ' ILE . 66.3 tp -131.69 123.53 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.682 HD13 HD22 ' A' ' 124' ' ' LEU . 2.4 mp -120.62 123.38 70.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.84 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.641 ' CD1' HG21 ' A' ' 48' ' ' VAL . 4.7 mt -114.5 133.7 22.45 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.671 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.593 ' O ' HG11 ' A' ' 88' ' ' VAL . 58.5 Cg_exo -52.21 156.18 8.17 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.718 2.279 . . . . 0.0 112.479 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.67 -39.6 42.57 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.802 2.335 . . . . 0.0 113.247 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -86.89 -16.84 34.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.172 -0.211 . . . . 0.0 111.542 -179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.538 ' HB3' HG22 ' A' ' 39' ' ' ILE . 16.6 t70 -51.65 161.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.797 0.332 . . . . 0.0 111.103 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -100.76 126.71 47.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.853 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.622 HG21 ' O ' ' A' ' 85' ' ' TYR . 15.5 mm -53.32 -23.44 6.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.304 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.472 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 43.2 m -79.81 -38.39 33.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.078 0.466 . . . . 0.0 110.413 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.78 -43.01 48.03 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.297 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.7 t -66.1 -26.02 37.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.705 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.16 -30.99 71.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.996 0.426 . . . . 0.0 110.125 179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -82.68 -42.22 18.38 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.235 179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.485 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -62.81 -45.07 94.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.203 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 1.003 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.19 -57.47 4.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.209 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.19 -32.38 23.43 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.461 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -61.52 -41.64 97.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.393 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.9 tp10 -79.22 -24.47 43.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.857 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.1 t80 -63.99 -45.34 89.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.613 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.61 -34.31 72.9 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.252 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.2 m -79.4 -32.36 42.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.886 0.374 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.435 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -54.31 -34.68 61.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.137 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.549 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -75.89 -3.77 37.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.434 179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -100.87 -0.07 37.58 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.591 0.234 . . . . 0.0 111.271 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.8 HD13 ' OD1' ' A' ' 67' ' ' ASN . 64.1 mt -64.6 144.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.907 0.384 . . . . 0.0 111.051 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -40.36 97.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.145 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.531 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.2 t -77.03 111.64 12.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.886 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.458 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -57.96 -47.55 82.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.025 0.44 . . . . 0.0 110.334 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.66 -30.31 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.646 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.891 ' O ' HG23 ' A' ' 71' ' ' VAL . 27.1 t-20 -74.13 -47.75 34.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.022 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 69' ' ' LEU . 3.2 ptt180 -62.78 -33.26 74.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.074 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 3.8 mm? -74.67 -30.69 61.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.774 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -79.78 -28.57 40.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.065 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.891 HG23 ' O ' ' A' ' 67' ' ' ASN . 40.2 t -76.47 -53.5 15.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.19 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.549 HD11 ' OG ' ' A' ' 60' ' ' SER . 8.9 mt -55.47 -36.02 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.103 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.97 -57.17 20.69 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -56.91 -42.46 79.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 1.003 HG23 HD12 ' A' ' 52' ' ' LEU . 92.0 mt -60.15 -41.78 87.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.666 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.2 m -58.98 -30.06 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.632 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.1 m -79.51 -43.29 23.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.632 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.1 t -53.12 -51.12 41.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.131 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' HA ' HD12 ' A' ' 82' ' ' LEU . 2.3 mt-30 -56.97 -44.23 82.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.63 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -59.35 -27.9 66.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.694 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -82.7 -41.45 19.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.839 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 79' ' ' GLN . 14.3 mt -62.98 -35.88 81.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -67.42 -3.05 7.3 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.769 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.8 mt -98.29 -9.68 25.1 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.904 0.383 . . . . 0.0 110.243 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.622 ' O ' HG21 ' A' ' 45' ' ' ILE . 3.4 m-85 -115.62 116.78 28.71 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.684 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -71.97 -30.01 64.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.893 0.378 . . . . 0.0 110.644 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.37 172.91 14.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.023 179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' A' ' 93' ' ' LEU . 91.4 t -84.52 128.39 61.72 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.435 0.159 . . . . 0.0 110.792 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -41.79 163.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.674 2.249 . . . . 0.0 112.736 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.09 -25.59 37.76 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.81 2.34 . . . . 0.0 112.636 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -103.08 -38.4 7.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.43 171.24 23.21 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -119.07 123.77 45.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.236 0.518 . . . . 0.0 110.934 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 38' ' ' ILE . 70.0 t -136.93 112.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.97 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 93' ' ' LEU . 29.2 t -116.39 150.22 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.501 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 23.0 m-85 -131.45 121.57 24.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.034 0.445 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 90.6 m -131.3 131.36 43.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.773 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.06 168.53 40.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.432 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 90.1 m -111.89 122.61 48.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.763 0.316 . . . . 0.0 110.941 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.571 HG22 ' C ' ' A' ' 28' ' ' ARG . 2.8 pp -123.73 167.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 14.6 t -118.85 147.24 22.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.528 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.7 p -104.62 169.58 8.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.407 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.53 -38.88 69.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.945 0.402 . . . . 0.0 110.487 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -63.26 -14.73 52.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.658 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.74 -3.46 74.42 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.367 -0.921 . . . . 0.0 112.87 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -80.28 134.36 36.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.874 0.368 . . . . 0.0 110.716 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.27 118.46 24.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.9 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.404 ' O ' HG13 ' A' ' 100' ' ' ILE . 0.0 OUTLIER -122.28 121.75 37.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 mtmm -78.09 140.16 39.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.174 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 41.0 t -110.04 107.0 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.947 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -117.79 110.55 17.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.533 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -128.08 142.37 43.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.935 0.398 . . . . 0.0 111.676 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -132.94 136.4 46.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.315 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.794 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 15.8 p90 -169.44 170.26 8.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.079 0.466 . . . . 0.0 111.693 -179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -98.58 142.02 23.9 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.116 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.479 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 38.5 Cg_exo -55.38 164.33 4.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.341 2.027 . . . . 0.0 112.697 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.931 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 16.7 t80 -64.08 -38.76 92.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.187 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -141.86 162.76 44.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.038 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.699 ' O ' HD13 ' A' ' 120' ' ' ILE . 51.9 Cg_exo -52.69 132.73 47.42 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.138 1.892 . . . . 0.0 112.2 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.699 HD13 ' O ' ' A' ' 119' ' ' PRO . 22.2 mm -128.11 112.8 28.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.541 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -91.61 44.02 1.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.628 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 16.7 m -155.72 112.13 3.14 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.631 -0.258 . . . . 0.0 111.175 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 10.2 p -77.23 113.23 14.77 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.843 0.354 . . . . 0.0 111.268 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 126' ' ' LEU . 8.5 tt -106.41 119.69 39.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.285 -179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.776 ' C ' HD13 ' A' ' 126' ' ' LEU . 1.7 t80 -131.31 118.29 20.13 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.618 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.792 HD21 HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.56 152.63 33.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.578 0.704 . . . . 0.0 112.109 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 30.9 t -123.32 130.44 52.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.843 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -159.89 -163.67 1.18 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.844 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.436 ' OD1' HG22 ' A' ' 32' ' ' THR . 12.3 m120 -83.15 3.67 29.83 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.42 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.82 153.28 18.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.784 0.326 . . . . 0.0 110.748 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.813 ' CD2' HD22 ' A' ' 24' ' ' LEU . 69.5 m-85 -74.58 127.85 34.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.477 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -76.33 103.61 6.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.869 0.366 . . . . 0.0 110.906 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.702 HG22 HD12 ' A' ' 136' ' ' LEU . 2.9 p -96.83 24.68 5.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 5.7 pt-20 -60.13 -39.18 85.39 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.643 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.41 -27.71 59.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.939 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.794 HD11 ' HZ ' ' A' ' 114' ' ' PHE . 19.5 mt -78.82 -49.19 13.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.044 0.449 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 21.3 m -78.28 -14.39 59.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.099 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -56.02 -42.33 76.31 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.576 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -55.31 -56.29 21.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.83 -179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.53 -40.23 86.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.4 m -69.96 -31.56 69.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.904 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.884 -179.966 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 ptm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.838 0.351 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.93 168.31 12.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.091 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -89.62 8.35 31.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.231 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -83.61 150.13 58.97 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-O 120.714 0.292 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -62.45 -151.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.609 2.206 . . . . 0.0 111.695 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -141.87 139.96 32.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.811 0.339 . . . . 0.0 111.076 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.54 -56.78 2.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.58 -36.5 82.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.93 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -62.29 -36.39 81.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.666 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 0.6 OUTLIER -48.15 -30.53 4.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.164 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.567 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.8 m120 -78.96 -39.64 33.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.617 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 20.8 t -60.66 -36.83 73.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.412 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.65 -40.17 93.97 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.866 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.33 -30.09 45.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.035 178.795 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.449 ' CH2' ' CD ' ' A' ' 19' ' ' LYS . 8.6 t-105 -74.43 -45.04 49.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.816 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -73.05 -44.96 60.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.214 0.53 . . . . 0.0 109.988 179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.458 HD13 ' CD2' ' A' ' 117' ' ' PHE . 1.1 mt -62.8 -37.17 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.239 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 12.7 ttmt -59.91 -42.07 93.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.984 0.421 . . . . 0.0 110.193 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.449 ' CD ' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -80.04 -21.04 43.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.996 179.639 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 mt -79.35 -43.3 23.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.979 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.649 ' HA ' HD12 ' A' ' 24' ' ' LEU . 12.8 pt -62.28 -47.91 90.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.252 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 21' ' ' ILE . 13.7 ptmt -53.86 -38.52 64.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.787 0.327 . . . . 0.0 111.085 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.32 -32.7 74.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.913 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.9 mt -78.4 -38.3 41.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -58.94 -29.52 67.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.971 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.21 -17.2 35.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.885 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -88.05 129.0 35.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.908 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -146.18 140.64 26.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.11 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -113.49 168.2 12.52 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.324 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.2 OUTLIER -114.21 99.74 7.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.807 0.337 . . . . 0.0 111.544 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.22 32.13 3.34 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.952 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 p 69.37 61.05 0.3 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.341 0.591 . . . . 0.0 110.415 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.406 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 1.5 m -105.33 29.51 6.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.383 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.473 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -134.29 113.2 11.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.019 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.443 HG23 ' HE1' ' A' ' 125' ' ' TYR . 46.9 mt -107.53 124.62 63.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.18 0.515 . . . . 0.0 111.738 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -113.13 121.18 43.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.273 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.675 HD21 HG11 ' A' ' 48' ' ' VAL . 24.4 tp -129.92 125.81 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.051 0.453 . . . . 0.0 111.738 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.629 ' HA ' HG22 ' A' ' 94' ' ' VAL . 5.1 mp -123.21 122.57 65.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.341 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.752 HG12 HG21 ' A' ' 48' ' ' VAL . 11.0 mt -113.44 138.07 22.36 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.433 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.591 ' O ' HG11 ' A' ' 88' ' ' VAL . 35.3 Cg_exo -60.45 156.08 43.47 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.59 2.194 . . . . 0.0 112.232 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.57 -39.1 22.47 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.656 2.238 . . . . 0.0 112.636 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 23.9 mmtp -81.6 -16.38 51.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.327 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.424 ' HB3' HG22 ' A' ' 39' ' ' ILE . 4.0 t70 -75.03 155.45 37.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.553 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -98.23 152.1 19.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.95 0.405 . . . . 0.0 111.224 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.401 HG21 ' O ' ' A' ' 85' ' ' TYR . 7.4 mm -58.75 -48.94 84.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.223 179.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.625 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.4 m -55.57 -34.53 64.86 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.06 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -52.16 -55.12 23.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.597 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.752 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -63.1 -22.18 30.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.807 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -55.63 -33.96 64.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.761 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -47.96 23.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.411 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.67 -45.56 89.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.447 179.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.55 -57.62 4.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.291 179.507 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.92 -30.62 47.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.546 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -63.74 -45.71 88.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.61 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -79.92 -23.64 41.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.912 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 53.1 t80 -64.29 -45.0 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.791 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -69.82 -43.16 67.7 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.38 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 12.6 m -65.22 -29.25 70.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.729 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.72 -31.41 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.056 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.61 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.7 m -74.27 -5.36 41.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.405 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -102.06 0.97 35.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.415 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.554 HD12 ' HA ' ' A' ' 68' ' ' ARG . 52.6 mt -64.79 144.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.952 0.406 . . . . 0.0 111.023 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.4 tptt -70.04 -38.09 75.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.023 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.545 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.1 t -76.45 132.73 39.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -71.87 -54.3 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.267 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.3 t -59.37 -33.81 52.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.559 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.897 ' O ' HG23 ' A' ' 71' ' ' VAL . 41.2 t30 -71.21 -44.77 64.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.224 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.554 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.6 ppt_? -68.35 -32.92 73.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.093 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.469 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.2 mp -74.59 -31.0 61.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.3 t -77.11 -26.92 53.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.272 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.897 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.5 t -81.66 -53.59 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.34 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.61 HD11 ' OG ' ' A' ' 60' ' ' SER . 87.3 mt -56.85 -45.37 82.46 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.996 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.9 -55.76 27.93 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.495 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -55.86 -45.42 78.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.736 0.303 . . . . 0.0 111.112 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 56' ' ' PHE . 64.3 mt -60.84 -41.43 88.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.618 179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.0 m -53.23 -35.36 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.56 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.1 m -74.61 -38.62 62.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.595 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 74' ' ' ALA . 40.5 t -57.06 -54.29 32.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.782 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -57.09 -35.73 69.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.682 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.426 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 9.2 mm-40 -60.62 -35.98 77.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.467 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.43 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.81 -34.42 26.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.655 179.336 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.54 -39.3 93.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.637 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.681 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.53 -6.15 13.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.157 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.681 HD23 ' HD3' ' A' ' 83' ' ' LYS . 13.9 mt -91.99 -10.68 38.4 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 121.047 0.451 . . . . 0.0 110.065 178.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.401 ' O ' HG21 ' A' ' 45' ' ' ILE . 47.2 m-85 -122.31 114.51 20.89 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.334 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -71.84 -39.44 69.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.072 0.463 . . . . 0.0 110.204 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -137.32 169.02 18.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.498 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.835 HG13 ' HB2' ' A' ' 93' ' ' LEU . 88.7 t -82.47 133.47 49.93 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 120.61 0.243 . . . . 0.0 111.106 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.457 ' CD ' HD23 ' A' ' 93' ' ' LEU . 80.7 Cg_exo -46.57 164.92 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.668 2.246 . . . . 0.0 112.586 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.66 -38.15 55.02 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.675 2.25 . . . . 0.0 112.556 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -89.92 -37.96 14.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.452 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.58 -177.73 34.25 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.495 -0.859 . . . . 0.0 111.596 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.835 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.7 tm? -130.92 120.63 23.86 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.875 0.369 . . . . 0.0 110.725 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.629 HG22 ' HA ' ' A' ' 38' ' ' ILE . 84.2 t -135.26 112.13 13.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 112' ' ' ILE . 39.5 t -116.62 148.11 19.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.477 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.4 m-30 -128.71 121.52 28.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.002 0.429 . . . . 0.0 110.994 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 93.6 m -132.47 129.16 38.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.406 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.26 168.67 41.03 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.43 -0.891 . . . . 0.0 112.987 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 m -111.74 118.66 36.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.67 0.272 . . . . 0.0 110.545 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.885 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.3 pt -113.32 163.69 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.925 0.393 . . . . 0.0 111.378 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.446 HG21 ' OD1' ' A' ' 30' ' ' ASN . 14.8 t -117.58 143.06 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.073 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 80.4 p -104.6 161.28 14.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.48 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.52 -34.46 49.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 0.0 110.48 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.0 -14.53 60.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 91.96 16.97 49.54 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.662 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -104.93 136.21 44.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.816 0.341 . . . . 0.0 110.685 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.423 ' HG3' HG22 ' A' ' 101' ' ' VAL . 3.7 mp0 -90.27 118.53 29.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.656 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.49 ' O ' HG13 ' A' ' 100' ' ' ILE . 7.6 mtpp -117.24 120.9 39.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.063 0.459 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.77 140.52 44.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.269 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.4 t -117.53 106.76 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.902 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -116.43 111.38 19.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.641 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.7 mt -127.87 139.23 52.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.726 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -134.24 131.78 38.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.257 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.635 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 31.2 p90 -170.09 170.28 7.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.008 0.432 . . . . 0.0 111.706 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -92.36 144.0 28.24 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.187 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.48 168.05 8.74 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.571 2.181 . . . . 0.0 112.932 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.866 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -60.33 -38.08 82.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.964 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 164.77 19.4 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.357 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.593 ' O ' HD13 ' A' ' 120' ' ' ILE . 8.6 Cg_endo -50.48 132.63 35.73 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.379 2.053 . . . . 0.0 112.302 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.593 HD13 ' O ' ' A' ' 119' ' ' PRO . 18.5 mm -128.19 113.06 28.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.258 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -90.33 44.55 1.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.524 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.2 m -154.21 112.18 3.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.697 0.284 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.413 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.8 OUTLIER -80.52 109.91 15.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.919 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.608 HD22 HD12 ' A' ' 126' ' ' LEU . 2.4 tt -109.46 122.37 47.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.523 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.443 ' HE1' HG23 ' A' ' 35' ' ' ILE . 10.6 t80 -130.37 119.53 22.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.457 179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.627 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.68 152.45 32.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 112.509 -179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 45.6 t -123.3 127.06 48.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.59 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -152.93 -176.5 5.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.12 -179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.46 ' C ' ' HG3' ' A' ' 34' ' ' MET . 1.4 m-20 -75.92 -1.77 27.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.62 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -154.05 144.77 22.49 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.74 0.305 . . . . 0.0 110.903 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.477 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.1 m-85 -63.26 125.33 23.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.767 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.476 ' HB2' HD21 ' A' ' 126' ' ' LEU . 17.6 m-70 -94.0 100.76 12.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.856 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.04 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -88.43 53.1 2.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.88 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.657 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 20.5 tt0 -67.06 -45.55 77.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.758 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.42 72.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.04 HD12 HG22 ' A' ' 133' ' ' THR . 52.0 mt -80.04 -51.91 8.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.043 0.449 . . . . 0.0 110.752 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.9 m -69.18 -17.08 63.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.031 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.657 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -57.24 -40.66 78.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.448 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.1 OUTLIER -70.97 -56.22 6.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.828 0.347 . . . . 0.0 110.797 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 140' ' ' LEU . 3.7 mm? -55.94 -35.41 66.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.089 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 59.1 m -79.89 -47.95 14.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 t0 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.923 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 168.92 12.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.91 2.74 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.282 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -86.85 150.14 49.69 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 120.623 0.249 . . . . 0.0 110.537 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.79 -84.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.508 2.138 . . . . 0.0 112.118 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB2' ' CB ' ' A' ' 9' ' ' ASP . 63.0 p -106.35 111.8 24.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.789 0.328 . . . . 0.0 111.034 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -90.35 -80.25 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.975 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.5 -29.28 69.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.88 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.469 ' CB ' ' HB2' ' A' ' 6' ' ' SER . 0.1 OUTLIER -57.74 -35.03 70.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.724 179.758 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.4 ttp180 -50.04 -31.3 12.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.108 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.608 ' O ' HG22 ' A' ' 14' ' ' ILE . 22.3 m120 -73.9 -42.39 60.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 22.2 t -59.94 -38.11 75.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' HD12 ' A' ' 17' ' ' ILE . 28.8 mt-10 -60.83 -37.65 82.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.904 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -62.78 -30.69 50.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.037 178.834 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.466 ' CZ3' ' HD2' ' A' ' 19' ' ' LYS . 8.9 t-105 -74.03 -42.51 60.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.604 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.7 -43.97 44.52 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.239 0.542 . . . . 0.0 109.666 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.577 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.2 mt -61.62 -37.06 77.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.334 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -62.22 -42.16 99.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.088 0.47 . . . . 0.0 109.887 179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 15' ' ' TRP . 15.2 mtpp -79.98 -28.21 39.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.825 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mt -74.33 -47.86 31.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.301 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.744 HD12 ' N ' ' A' ' 22' ' ' LYS . 2.4 pp -54.69 -49.81 65.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.461 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' N ' HD12 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.35 -42.79 82.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.266 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -58.91 -33.44 70.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.214 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.893 HD22 ' CD2' ' A' ' 131' ' ' PHE . 56.9 mt -78.66 -32.03 47.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.225 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.25 -25.51 65.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.391 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.27 -16.72 27.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.768 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.566 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.25 122.59 28.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.084 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.43 130.34 30.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.878 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -102.46 -176.02 27.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -112.6 95.61 5.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.83 0.348 . . . . 0.0 110.979 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.94 31.13 3.71 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.614 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.494 HG22 ' CG ' ' A' ' 129' ' ' ASN . 74.9 p 49.86 64.99 1.55 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 111.296 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.8 t -101.98 24.53 9.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.992 0.425 . . . . 0.0 110.418 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.36 122.24 45.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.765 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' C ' ' A' ' 74' ' ' ALA . 60.1 mt -111.21 125.46 68.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 0.0 112.107 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.46 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 2.2 t -111.68 123.16 49.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.364 -0.834 . . . . 0.0 108.993 178.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.505 HD21 HG11 ' A' ' 48' ' ' VAL . 9.1 tp -131.15 122.75 27.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.029 0.442 . . . . 0.0 112.094 -178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.82 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.4 mp -116.5 120.86 66.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.964 179.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 HD12 ' A' ' 93' ' ' LEU . 13.0 mt -115.74 132.49 23.14 Favored Pre-proline 0 C--N 1.329 -0.285 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 53.1 Cg_exo -54.88 156.51 15.18 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.795 2.33 . . . . 0.0 112.254 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.67 -39.37 21.06 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.729 2.286 . . . . 0.0 112.98 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -84.6 -16.13 43.18 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.495 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -70.62 165.42 22.87 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.53 148.27 28.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.798 0.332 . . . . 0.0 110.652 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.743 HD11 ' O ' ' A' ' 87' ' ' LYS . 25.7 mt -62.67 -53.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.396 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 88.4 p -53.81 -29.4 40.49 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.94 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -53.2 59.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.635 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.505 HG11 HD21 ' A' ' 37' ' ' LEU . 1.5 t -58.36 -21.57 18.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.108 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.24 -31.52 21.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.804 0.335 . . . . 0.0 111.012 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -54.05 10.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.508 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.45 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.89 -43.32 90.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.53 179.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.95 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.7 -57.87 5.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.499 179.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.81 -32.49 60.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -62.43 -39.64 93.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.593 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -82.14 -23.9 35.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.89 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.806 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.2 t80 -66.89 -42.53 85.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.75 -40.05 85.52 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.369 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.8 m -72.92 -27.58 61.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.809 0.338 . . . . 0.0 110.898 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.61 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -58.76 -32.85 69.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.061 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.525 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.5 m -77.04 -3.01 36.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.369 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -104.4 1.7 30.41 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.618 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.704 HD13 ' OD1' ' A' ' 67' ' ' ASN . 66.0 mt -64.83 144.34 14.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.93 0.395 . . . . 0.0 110.996 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -64.71 -41.18 96.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 62' ' ' ILE . 2.7 t -72.14 137.17 46.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.885 0.374 . . . . 0.0 110.834 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.79 -56.14 6.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.975 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.75 -34.49 68.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.085 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.704 ' OD1' HD13 ' A' ' 62' ' ' ILE . 20.3 t-20 -63.15 -51.02 68.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.036 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.632 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.6 OUTLIER -60.22 -35.32 75.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.96 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.509 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 4.1 mm? -74.88 -32.66 61.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.637 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.2 t -67.34 -32.38 73.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.239 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 59' ' ' ALA . 19.0 t -81.37 -53.51 12.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.555 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.525 HD11 ' OG ' ' A' ' 60' ' ' SER . 24.2 mt -55.49 -41.2 72.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.103 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.05 -54.64 35.08 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.505 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.0 -46.3 85.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.811 0.339 . . . . 0.0 111.075 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.95 HG23 HD12 ' A' ' 52' ' ' LEU . 98.0 mt -58.44 -43.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.8 m -57.76 -31.42 66.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.717 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.3 m -76.42 -38.28 55.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.0 t -56.97 -52.75 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.916 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.502 ' HA ' HD12 ' A' ' 82' ' ' LEU . 1.9 mt-30 -57.83 -39.66 78.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -59.57 -32.6 70.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.765 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 13.7 mmt180 -82.59 -36.03 26.54 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.594 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.706 HD22 HG23 ' A' ' 45' ' ' ILE . 36.2 mt -64.95 -32.85 74.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.43 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -70.5 -4.84 24.83 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.259 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.601 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.3 mt -97.45 -6.07 34.67 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.252 178.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.445 ' HB2' HD13 ' A' ' 45' ' ' ILE . 3.1 m-85 -119.15 124.62 47.27 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.685 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -72.04 -34.99 69.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.979 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.743 ' O ' HD11 ' A' ' 45' ' ' ILE . 2.9 pttp -156.06 -178.47 7.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.208 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.848 HG13 ' HB2' ' A' ' 93' ' ' LEU . 60.5 t -83.03 132.53 50.47 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.657 0.265 . . . . 0.0 111.486 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.438 ' CD ' HD23 ' A' ' 93' ' ' LEU . 81.0 Cg_exo -46.79 165.03 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.358 . . . . 0.0 112.596 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.08 -35.99 64.0 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.824 2.35 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -90.78 -38.9 12.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.465 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 158.96 178.54 33.06 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.867 -0.682 . . . . 0.0 111.51 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.848 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.6 tm? -126.95 119.98 28.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.977 0.417 . . . . 0.0 110.706 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.82 HG22 ' HA ' ' A' ' 38' ' ' ILE . 64.7 t -135.97 112.19 12.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.336 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.626 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.6 t -116.13 150.1 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.468 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.5 m-30 -130.33 117.95 20.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 76.9 m -129.13 130.47 46.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.733 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.38 165.43 38.8 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.463 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 73.0 m -113.3 122.98 49.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 110.918 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.566 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -123.44 175.19 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.078 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.4 t -120.45 148.81 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.348 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.7 p -104.58 163.33 12.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.393 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.44 -35.09 51.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.075 0.464 . . . . 0.0 110.437 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.67 -14.41 62.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.463 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 97.32 -5.25 62.76 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.874 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.49 136.88 33.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.776 0.322 . . . . 0.0 110.887 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -91.73 120.12 32.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -117.26 121.39 41.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.993 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -72.91 130.96 41.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.166 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 33.2 t -102.98 107.0 21.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.568 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -119.08 110.45 17.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.626 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -129.06 141.38 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.36 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -138.63 132.06 30.37 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.452 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.449 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 10.1 p90 -169.4 170.17 8.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.982 0.42 . . . . 0.0 111.652 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -87.86 145.96 37.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.249 179.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.564 ' CB ' HD11 ' A' ' 120' ' ' ILE . 38.0 Cg_endo -66.68 168.12 17.51 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.423 2.082 . . . . 0.0 112.484 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.904 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 12.3 t80 -62.94 -42.51 99.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' CB ' ' HD2' ' A' ' 119' ' ' PRO . 2.8 mtmp? -138.99 165.68 30.43 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.804 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 118' ' ' LYS . 8.0 Cg_endo -49.84 133.3 33.44 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.713 2.275 . . . . 0.0 112.502 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.666 HG22 ' H ' ' A' ' 122' ' ' THR . 13.2 mm -96.48 153.28 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.428 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -136.83 17.45 3.06 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.989 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.666 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.0 m -156.26 111.87 2.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.668 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.3 p -76.92 112.58 13.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.712 0.291 . . . . 0.0 110.486 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.705 HD13 ' OE2' ' A' ' 134' ' ' GLU . 1.2 tt -117.75 130.94 56.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 112.036 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.64 ' N ' HD23 ' A' ' 124' ' ' LEU . 85.2 t80 -130.42 124.64 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.356 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.642 ' O ' HD22 ' A' ' 126' ' ' LEU . 0.0 OUTLIER -152.26 152.49 32.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.478 0.656 . . . . 0.0 112.507 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 2.6 t -124.88 130.25 52.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.081 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -155.69 -169.45 3.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.852 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.494 ' CG ' HG22 ' A' ' 32' ' ' THR . 19.3 m120 -80.36 4.54 17.58 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.517 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -162.3 153.49 17.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.893 ' CD2' HD22 ' A' ' 24' ' ' LEU . 57.7 m-85 -72.26 125.26 26.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.544 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.425 ' HB2' HD21 ' A' ' 126' ' ' LEU . 7.2 m-70 -85.4 105.45 16.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.883 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.83 HG22 HD12 ' A' ' 136' ' ' LEU . 5.6 p -95.68 40.04 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.991 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.705 ' OE2' HD13 ' A' ' 124' ' ' LEU . 4.0 pt-20 -60.3 -46.1 91.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.732 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.55 -27.67 58.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.086 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.83 HD12 HG22 ' A' ' 133' ' ' THR . 15.7 mt -77.07 -46.18 24.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.503 HG22 ' HG ' ' A' ' 141' ' ' SER . 0.7 OUTLIER -81.64 1.44 34.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.248 179.621 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.88 86.15 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.623 0.249 . . . . 0.0 111.614 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.765 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -69.56 -56.57 6.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.838 0.351 . . . . 0.0 110.57 -179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.536 HD11 HG13 ' A' ' 14' ' ' ILE . 11.0 mp -56.0 -40.71 73.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.211 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.503 ' HG ' HG22 ' A' ' 137' ' ' THR . 68.6 m -73.26 -31.52 64.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.879 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.862 -179.974 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ptp . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.777 0.322 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.37 168.32 20.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.195 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -88.49 -26.98 21.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.033 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -62.87 149.8 89.11 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.67 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.59 -78.84 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.355 2.037 . . . . 0.0 112.116 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -163.84 30.52 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.772 0.32 . . . . 0.0 111.335 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.64 -87.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.891 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.79 -26.07 67.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.82 0.343 . . . . 0.0 110.787 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.77 76.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.721 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -51.03 -30.5 15.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.938 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.659 ' O ' HG22 ' A' ' 14' ' ' ILE . 26.5 m120 -77.53 -41.65 38.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.099 0.476 . . . . 0.0 110.303 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.6 t -65.51 -34.57 71.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.268 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.672 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.2 mm-40 -68.96 -38.63 79.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.813 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.56 -30.48 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.806 178.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.426 ' CD1' ' HD3' ' A' ' 16' ' ' LYS . 7.5 t-105 -68.39 -42.99 78.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.355 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 19.1 mmtt -76.18 -43.63 41.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.61 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.3 mt -63.07 -35.41 71.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 ttmm -63.67 -48.37 77.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.389 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.3 pttt -78.92 -22.46 45.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.94 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.28 -53.41 12.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.09 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 17' ' ' ILE . 13.8 pt -52.56 -48.88 46.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.243 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.46 ' N ' HG13 ' A' ' 21' ' ' ILE . 4.7 mptt -52.72 -46.32 67.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.204 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -58.87 -33.78 70.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 131' ' ' PHE . 23.4 mt -78.67 -37.49 41.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.06 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -60.95 -29.52 69.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.016 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -91.07 -13.64 32.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.317 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.003 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -87.08 125.03 33.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -144.29 135.29 25.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.1 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -111.96 174.27 16.28 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.347 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -113.92 99.02 7.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.732 0.301 . . . . 0.0 111.407 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 105.18 31.62 4.31 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.775 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.739 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.2 m 74.69 70.37 0.1 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.171 0.51 . . . . 0.0 110.247 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.409 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.1 OUTLIER -109.08 29.04 7.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 -179.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.455 ' CE ' ' CE2' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.48 114.25 11.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.242 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.526 HD12 ' CB ' ' A' ' 74' ' ' ALA . 39.2 mt -106.64 120.54 57.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.029 0.442 . . . . 0.0 111.425 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.495 ' CB ' HD11 ' A' ' 126' ' ' LEU . 0.5 OUTLIER -109.09 121.69 45.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.615 178.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.753 HD21 HG11 ' A' ' 48' ' ' VAL . 11.1 tp -130.11 124.99 34.05 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.621 -178.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.657 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.2 mp -122.4 123.75 69.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.233 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.827 HG12 HG21 ' A' ' 48' ' ' VAL . 6.3 mt -117.71 137.96 24.78 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.758 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.601 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.3 Cg_exo -58.71 156.13 33.95 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.793 2.329 . . . . 0.0 112.417 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.31 -39.24 30.66 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.668 2.246 . . . . 0.0 112.677 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -81.06 -14.64 57.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.355 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.23 156.69 35.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.471 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -100.53 156.29 17.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.991 0.424 . . . . 0.0 110.989 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.548 HG23 HD22 ' A' ' 82' ' ' LEU . 13.8 mm -61.51 -51.68 70.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.011 179.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.629 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 1.6 m -55.36 -30.88 61.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 3.1 tpt180 -54.7 -57.13 12.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.634 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.827 HG21 HG12 ' A' ' 39' ' ' ILE . 1.4 t -58.11 -21.56 17.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.0 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -53.94 -30.24 45.82 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.787 0.327 . . . . 0.0 110.974 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -76.5 -52.23 10.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.722 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.509 ' HE1' ' CD1' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -58.25 -44.2 88.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.616 179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.764 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -67.95 -56.69 8.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.371 179.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.28 -31.15 20.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.716 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -62.89 -44.43 96.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.518 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.48 -23.78 50.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.908 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.655 ' HB2' HG21 ' A' ' 75' ' ' ILE . 89.4 t80 -67.03 -42.07 85.5 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.84 -41.19 42.47 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.363 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.3 m -69.56 -29.56 67.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.349 . . . . 0.0 110.759 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.77 -29.8 69.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.909 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.636 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.8 m -76.91 -4.99 46.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.267 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -102.16 2.06 36.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.329 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 68' ' ' ARG . 62.5 mt -64.44 141.4 18.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.977 0.418 . . . . 0.0 110.947 -179.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.931 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' 62' ' ' ILE . 18.4 t -70.61 132.39 45.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.881 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.407 ' O ' HD13 ' A' ' 69' ' ' LEU . 7.5 tpp180 -71.94 -57.02 4.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.17 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.78 -30.82 51.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.88 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.0 OUTLIER -74.24 -40.54 62.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.237 -179.684 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.681 ' HA ' HD12 ' A' ' 62' ' ' ILE . 2.5 ppt_? -66.38 -33.03 74.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 0.0 110.918 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.5 mp -74.56 -43.62 54.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.615 179.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.4 t -59.31 -29.23 67.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.93 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.88 HG23 ' O ' ' A' ' 67' ' ' ASN . 22.4 t -78.4 -53.55 13.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.102 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.636 HD11 ' OG ' ' A' ' 60' ' ' SER . 88.9 mt -59.13 -40.17 84.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.42 -50.35 65.56 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.336 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.526 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -59.47 -47.15 86.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.842 0.353 . . . . 0.0 110.8 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.764 HG23 ' CD1' ' A' ' 52' ' ' LEU . 89.4 mt -59.97 -36.73 68.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.675 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.6 m -58.22 -33.9 69.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.9 m -75.02 -38.59 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.442 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 74' ' ' ALA . 26.5 t -56.31 -53.62 37.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.577 ' OE1' HG22 ' A' ' 75' ' ' ILE . 7.8 mp0 -54.01 -43.2 69.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.448 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -60.85 -28.16 68.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.523 179.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.435 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.9 OUTLIER -82.97 -41.2 19.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.874 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.548 HD22 HG23 ' A' ' 45' ' ' ILE . 79.7 mt -63.74 -33.15 75.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.532 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.701 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.69 -5.9 23.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.51 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD23 ' HD3' ' A' ' 83' ' ' LYS . 1.0 OUTLIER -95.92 -10.92 27.52 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.905 0.383 . . . . 0.0 110.29 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -116.36 116.43 27.7 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.578 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -71.93 -28.93 63.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.034 0.445 . . . . 0.0 110.667 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -152.51 172.07 17.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.647 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.818 HG13 ' HB2' ' A' ' 93' ' ' LEU . 85.8 t -81.3 132.6 55.5 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 120.557 0.218 . . . . 0.0 111.12 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.416 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 88.5 Cg_exo -45.82 164.91 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.694 2.263 . . . . 0.0 112.649 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.48 -40.04 63.6 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.609 2.206 . . . . 0.0 112.339 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.0 m-20 -86.21 -39.52 16.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.153 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.93 179.63 32.96 Favored Glycine 0 N--CA 1.448 -0.564 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -124.43 120.04 30.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 117.069 0.435 . . . . 0.0 110.844 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 38' ' ' ILE . 98.3 t -135.9 112.15 12.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.617 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.672 HG13 ' O ' ' A' ' 112' ' ' ILE . 49.0 t -117.13 149.37 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.482 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.9 m-30 -129.86 116.78 19.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.988 0.423 . . . . 0.0 110.841 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 85.4 m -128.05 131.62 49.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.782 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.02 168.56 40.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.864 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 5.6 m -116.03 112.89 22.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.744 0.307 . . . . 0.0 110.503 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 1.003 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.5 pp -110.12 170.94 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.897 0.38 . . . . 0.0 111.432 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.6 t -119.42 146.23 24.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.166 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 68.9 p -104.74 161.56 14.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -31.35 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.999 0.428 . . . . 0.0 110.527 179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -65.95 -14.55 61.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.497 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 89.88 20.1 44.75 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.603 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mmmm -110.61 141.02 44.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.834 0.35 . . . . 0.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -91.54 118.48 30.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.837 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.6 mmmt -117.47 121.53 41.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.786 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 19.8 ttmt -73.56 140.26 46.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.278 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 30.5 t -118.96 107.0 20.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.732 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.79 110.44 18.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.826 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -126.56 139.82 50.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.986 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -135.24 131.64 36.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.572 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.487 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.99 170.12 7.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.981 0.42 . . . . 0.0 111.445 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.416 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.6 pt-20 -92.4 143.2 26.95 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.184 179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.497 ' HD3' HG23 ' A' ' 94' ' ' VAL . 18.5 Cg_endo -57.95 164.78 7.59 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.395 2.063 . . . . 0.0 112.324 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.813 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 1.8 t80 -58.54 -38.39 77.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.954 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -142.34 164.91 30.37 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.376 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 18.2 Cg_endo -59.84 132.57 45.86 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.075 1.85 . . . . 0.0 112.218 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.1 mm -128.54 112.92 27.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.284 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -86.5 46.16 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.729 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 15.5 m -154.41 112.01 3.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.703 0.287 . . . . 0.0 111.248 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 0.8 OUTLIER -81.09 111.05 17.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.04 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -115.61 125.68 53.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.576 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.623 ' N ' HD23 ' A' ' 124' ' ' LEU . 71.7 t80 -130.35 124.92 33.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.372 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.628 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.41 152.09 33.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.474 0.654 . . . . 0.0 112.098 -179.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.618 ' SG ' HG22 ' A' ' 32' ' ' THR . 2.3 t -124.82 129.71 50.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.8 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.739 ' HA ' HG23 ' A' ' 32' ' ' THR . 9.0 t0 -155.65 -174.82 5.13 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.895 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.401 ' C ' ' HG3' ' A' ' 34' ' ' MET . 2.3 m120 -78.26 2.93 16.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.723 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt -157.25 147.96 21.39 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.787 0.327 . . . . 0.0 110.929 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.589 ' CD2' HD22 ' A' ' 24' ' ' LEU . 71.5 m-85 -67.19 127.53 32.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.6 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -94.77 94.1 7.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.966 HG22 HD12 ' A' ' 136' ' ' LEU . 1.1 p -88.75 52.53 2.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.911 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.578 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.3 mt-10 -69.59 -50.57 43.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.63 -28.29 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.158 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.966 HD12 HG22 ' A' ' 133' ' ' THR . 42.9 mt -79.11 -47.34 16.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.808 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 24.7 m -79.73 -15.86 56.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.993 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.72 -35.79 73.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.352 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.485 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -59.11 -56.33 23.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.808 0.337 . . . . 0.0 110.83 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.01 -40.47 93.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.963 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 36.5 m -70.6 -31.43 68.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.867 -179.966 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.916 0.389 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.76 168.33 0.93 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.137 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -93.89 -26.88 16.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.049 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.0 p-10 -66.82 144.24 98.46 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.832 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -63.14 -69.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.491 2.127 . . . . 0.0 112.205 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.1 p -161.98 145.42 12.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.058 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.17 -46.36 8.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.117 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.61 -33.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.023 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -71.29 -35.85 71.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 2.4 mtm180 -48.22 -30.5 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.043 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.571 ' O ' HG22 ' A' ' 14' ' ' ILE . 34.8 m120 -79.43 -39.65 31.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.51 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 21.9 t -61.86 -36.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.2 mt-10 -65.08 -37.84 88.82 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.791 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.78 -32.91 55.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.846 178.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.415 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 7.2 t-105 -66.86 -42.28 85.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.322 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.66 -43.37 47.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.701 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.551 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mt -64.96 -35.65 75.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.388 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -62.65 -49.78 73.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.37 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -77.74 -21.01 52.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.04 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mt -74.78 -51.33 14.42 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.149 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.727 ' HA ' HD12 ' A' ' 24' ' ' LEU . 16.3 pt -54.62 -47.28 72.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.41 -179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 21' ' ' ILE . 11.7 tptt -52.37 -45.66 65.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.37 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -33.57 72.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.164 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 21' ' ' ILE . 4.9 mt -78.71 -28.62 45.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.276 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -70.21 -31.58 69.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.277 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.4 -18.01 29.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.12 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.857 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -79.54 123.77 27.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.242 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.67 130.39 24.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -97.63 -176.45 34.01 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.588 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' OD1' HG21 ' A' ' 101' ' ' VAL . 0.1 OUTLIER -114.0 100.44 8.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.795 0.331 . . . . 0.0 110.908 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.91 24.37 6.36 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.905 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.892 HG22 ' OD1' ' A' ' 129' ' ' ASN . 12.2 p 54.48 60.76 3.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.824 0.345 . . . . 0.0 111.117 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 t -105.74 29.11 6.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.013 0.435 . . . . 0.0 110.722 -179.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.488 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.4 OUTLIER -107.19 125.06 50.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.459 179.645 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.417 HD13 ' OH ' ' A' ' 125' ' ' TYR . 48.6 mt -113.59 130.45 67.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.244 0.545 . . . . 0.0 112.227 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.492 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 8.3 t -112.1 122.6 48.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.22 -0.9 . . . . 0.0 108.985 178.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 48' ' ' VAL . 16.5 tp -132.61 128.66 37.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.202 0.525 . . . . 0.0 112.17 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 124' ' ' LEU . 3.7 mp -123.62 123.26 66.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.282 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.59 HG12 HG21 ' A' ' 48' ' ' VAL . 8.6 mt -114.9 128.4 25.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.765 0.317 . . . . 0.0 111.702 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.59 ' O ' HG11 ' A' ' 88' ' ' VAL . 77.6 Cg_exo -50.95 156.29 4.97 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.9 2.4 . . . . 0.0 112.543 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.84 -39.48 25.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.764 2.31 . . . . 0.0 113.053 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -16.32 54.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.591 0.234 . . . . 0.0 111.528 -179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.08 152.14 45.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.75 0.31 . . . . 0.0 110.648 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -97.39 146.01 25.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.566 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.0 -54.15 26.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.638 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.63 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 7.3 t -56.6 -30.09 62.83 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.787 0.327 . . . . 0.0 110.886 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -54.64 39.95 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.59 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -60.42 -23.97 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.73 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.63 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.48 -30.11 12.01 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.895 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -75.78 -51.09 13.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.534 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.443 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.33 -45.26 84.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.405 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.871 ' CD1' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -67.91 -55.62 12.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.057 179.208 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.16 -28.5 11.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.796 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -67.11 -47.11 72.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.52 -26.56 60.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.77 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.8 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.3 t80 -66.76 -44.41 81.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.783 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.18 -38.35 59.18 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.319 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.7 m -70.77 -28.42 64.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.898 0.38 . . . . 0.0 110.502 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.402 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -61.75 -31.72 71.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.966 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.523 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -78.22 -4.82 49.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.236 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 -101.78 2.55 38.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.271 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.831 HD12 ' HA ' ' A' ' 68' ' ' ARG . 66.5 mt -64.87 143.48 15.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.956 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -66.96 -39.17 87.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.798 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.556 ' H ' HG22 ' A' ' 62' ' ' ILE . 29.3 t -71.54 132.83 45.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.935 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -71.95 -53.3 13.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.091 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.25 -35.32 73.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.569 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.852 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.2 t30 -68.62 -45.36 72.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.2 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.831 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -60.77 -34.08 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.407 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 16.1 mt -74.66 -45.03 47.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.912 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -59.52 -32.82 70.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.089 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 67' ' ' ASN . 37.3 t -72.41 -53.66 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.199 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.523 HD11 ' OG ' ' A' ' 60' ' ' SER . 44.2 mt -57.88 -33.35 68.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.27 -57.69 17.85 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.634 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.86 -42.49 89.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.77 0.319 . . . . 0.0 110.967 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.871 HG23 ' CD1' ' A' ' 52' ' ' LEU . 66.3 mt -61.2 -41.75 90.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.575 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.8 m -57.03 -31.34 65.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.462 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.6 m -75.11 -40.12 60.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.459 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 52' ' ' LEU . 31.7 t -55.26 -49.53 71.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.889 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.18 -44.06 87.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.626 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.412 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 31.8 mm-40 -57.71 -30.25 65.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.569 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.436 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.2 mmt180 -82.94 -39.76 21.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.96 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.5 mt -61.15 -36.81 80.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.165 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.746 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -68.15 -5.61 18.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.436 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.746 HD23 ' HD3' ' A' ' 83' ' ' LYS . 8.5 mt -93.05 -12.83 29.6 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.903 0.382 . . . . 0.0 110.266 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.34 117.79 27.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.92 -36.61 70.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.084 0.469 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.24 170.14 16.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.646 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 93' ' ' LEU . 89.5 t -81.68 132.74 53.95 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.557 0.218 . . . . 0.0 110.763 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.423 ' CD ' HD23 ' A' ' 93' ' ' LEU . 92.7 Cg_exo -44.45 165.01 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.581 2.188 . . . . 0.0 112.529 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.41 -34.86 63.0 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.801 2.334 . . . . 0.0 112.392 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 10.1 m-20 -93.9 -37.14 11.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.547 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 156.83 176.86 29.39 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.262 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.836 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.8 tm? -123.63 121.3 35.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.943 0.372 . . . . 0.0 110.674 179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 38' ' ' ILE . 53.9 t -134.65 112.07 14.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.666 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 112' ' ' ILE . 47.7 t -116.31 148.24 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.0 m-30 -130.57 123.44 29.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.912 0.387 . . . . 0.0 110.894 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 69.8 m -130.75 130.89 44.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.97 -179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 34' ' ' MET . . . -168.33 168.62 41.03 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.371 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 4.2 m -110.46 126.0 53.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.756 0.312 . . . . 0.0 110.748 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.857 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -119.73 160.66 19.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.375 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.418 HG21 ' OD1' ' A' ' 30' ' ' ASN . 16.9 t -118.63 145.11 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.401 HG21 ' HE2' ' A' ' 108' ' ' LYS . 27.3 p -104.51 163.19 12.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.434 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -52.19 -35.88 50.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.959 0.409 . . . . 0.0 110.517 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.45 -14.58 57.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.502 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.3 24.69 28.27 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.594 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -108.89 134.38 51.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -90.8 118.48 30.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.754 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.401 ' HE2' HG21 ' A' ' 102' ' ' THR . 22.6 mtmt -117.27 121.42 41.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.896 0.379 . . . . 0.0 111.09 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -72.84 131.61 42.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.073 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 44.8 t -108.92 106.96 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.888 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -117.6 110.58 18.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.323 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -125.07 139.81 50.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.687 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -138.96 131.89 29.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.19 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.628 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.6 170.32 8.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.403 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 19.8 pt-20 -87.81 137.35 31.8 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.176 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.586 ' HG3' HG23 ' A' ' 94' ' ' VAL . 32.1 Cg_exo -58.42 168.06 4.28 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.385 2.056 . . . . 0.0 112.78 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 3.6 t80 -66.96 -42.04 85.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.227 179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.5 mtpt -135.74 163.77 48.15 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.862 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.436 ' O ' HD13 ' A' ' 120' ' ' ILE . 36.5 Cg_endo -65.99 132.27 29.65 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 121.929 1.752 . . . . 0.0 112.321 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 40' ' ' PRO . 24.4 mm -128.63 112.44 26.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.365 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -89.18 49.48 1.78 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.985 -179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 57.7 m -153.16 112.06 3.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.632 0.253 . . . . 0.0 111.461 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.512 ' OG ' ' HD3' ' A' ' 40' ' ' PRO . 1.2 m -75.66 108.41 8.48 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.73 0.3 . . . . 0.0 111.317 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 38' ' ' ILE . 3.2 tt -109.89 133.18 53.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.081 0.467 . . . . 0.0 111.901 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.704 ' N ' HD23 ' A' ' 124' ' ' LEU . 1.4 t80 -130.47 114.19 15.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.362 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.639 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.4 OUTLIER -137.26 131.77 32.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.007 0.432 . . . . 0.0 112.015 -179.425 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 34' ' ' MET . 52.8 t -120.87 129.56 53.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.223 179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 1.3 t70 -162.05 -160.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.619 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.892 ' OD1' HG22 ' A' ' 32' ' ' THR . 16.6 m120 -83.03 4.46 25.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.527 0.203 . . . . 0.0 111.456 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.4 ptmt -162.69 154.11 17.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.798 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.492 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.4 m-85 -74.54 125.4 28.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.65 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.639 ' CD2' HD22 ' A' ' 126' ' ' LEU . 19.2 m-70 -91.58 89.4 7.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.957 HG22 HD12 ' A' ' 136' ' ' LEU . 0.9 OUTLIER -71.8 64.91 0.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.899 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -73.67 -53.93 9.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.07 -30.24 70.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.957 HD12 HG22 ' A' ' 133' ' ' THR . 55.9 mt -79.83 -48.16 13.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.814 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 32.0 m -73.11 -18.86 61.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.032 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.73 -40.39 83.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.435 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -59.63 -56.21 24.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.822 -179.879 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 9.5 mp -61.35 -40.49 94.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 49.7 m -70.64 -31.5 68.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.853 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.968 179.973 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.834 0.349 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.71 168.22 0.93 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.191 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -102.3 -26.79 13.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.095 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.8 p-10 -59.09 144.48 82.66 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.876 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.58 -67.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.468 2.112 . . . . 0.0 112.293 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.1 p -151.86 148.72 28.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.072 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.67 -51.94 3.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.004 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.1 -27.52 69.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.194 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -31.85 73.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.933 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 9.7 mtp180 -53.34 -30.53 39.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.093 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.506 ' O ' HG22 ' A' ' 14' ' ' ILE . 35.8 m120 -72.13 -44.04 63.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.981 0.42 . . . . 0.0 110.41 179.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 35.2 t -54.01 -40.23 44.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.674 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.701 ' O ' HD12 ' A' ' 17' ' ' ILE . 1.3 mm-40 -56.13 -37.61 69.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.832 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -63.36 -32.25 55.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.098 178.896 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.482 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 8.5 t-105 -72.94 -41.84 64.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.796 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.427 ' HD3' ' CD1' ' A' ' 15' ' ' TRP . 10.0 mmtt -76.9 -43.29 36.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.796 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.701 HD12 ' O ' ' A' ' 13' ' ' GLU . 1.1 mp -63.79 -32.23 56.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.356 179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -46.26 79.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.065 0.46 . . . . 0.0 110.171 179.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.482 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.7 OUTLIER -75.41 -29.52 59.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.69 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.54 -53.22 24.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.342 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.431 HG23 ' O ' ' A' ' 17' ' ' ILE . 10.0 pt -52.18 -50.9 34.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.438 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -50.39 -45.59 55.57 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 t -60.51 -34.25 73.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.922 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' CD2' ' A' ' 131' ' ' PHE . 40.8 mt -78.71 -37.33 41.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -59.17 -32.9 70.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.045 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.47 -16.57 32.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.258 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -81.99 125.31 30.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.35 . . . . 0.0 111.186 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -146.47 130.67 17.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -101.94 177.37 26.53 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.642 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -113.87 104.21 11.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.953 0.406 . . . . 0.0 111.042 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 108.08 23.3 6.78 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.794 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.639 HG22 ' CG ' ' A' ' 129' ' ' ASN . 14.2 p 54.16 59.81 3.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.253 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.5 t -105.55 25.65 10.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.63 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.403 ' HG3' ' C ' ' A' ' 129' ' ' ASN . 0.6 OUTLIER -100.6 124.96 46.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.421 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.655 HD12 ' CB ' ' A' ' 74' ' ' ALA . 31.8 mt -111.95 125.12 69.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.6 OUTLIER -109.46 120.5 42.7 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.731 177.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.68 HD21 ' CG1' ' A' ' 48' ' ' VAL . 38.2 tp -126.87 118.97 25.66 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.95 0.405 . . . . 0.0 111.894 -178.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.679 HG23 ' CG2' ' A' ' 94' ' ' VAL . 1.8 mt -121.66 123.09 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.243 179.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.742 ' CD1' HG21 ' A' ' 48' ' ' VAL . 7.4 mt -115.59 138.17 23.65 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.607 ' O ' HG11 ' A' ' 88' ' ' VAL . 37.7 Cg_exo -56.77 156.3 23.69 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.795 2.33 . . . . 0.0 112.296 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.47 -39.11 47.78 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.735 2.29 . . . . 0.0 112.989 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.1 mttt -88.46 -16.78 31.89 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.26 169.33 0.19 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.887 0.375 . . . . 0.0 111.104 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -105.19 127.62 53.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.071 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.496 HG21 ' O ' ' A' ' 85' ' ' TYR . 13.9 mm -54.0 -23.34 9.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.286 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.457 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 45.8 m -79.42 -36.86 38.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.03 0.443 . . . . 0.0 110.455 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -44.29 49.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.007 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.742 HG21 ' CD1' ' A' ' 39' ' ' ILE . 1.4 t -68.51 -26.48 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.591 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -62.26 -31.49 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.029 0.442 . . . . 0.0 110.124 179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -82.42 -41.76 19.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.211 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -44.9 94.08 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.173 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.981 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.13 -57.65 4.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.284 179.373 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.0 -30.45 15.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.683 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.55 -41.51 90.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.428 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.77 -21.9 51.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.751 179.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.837 ' HB2' HG21 ' A' ' 75' ' ' ILE . 87.0 t80 -66.0 -45.31 82.04 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.668 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.53 -33.83 77.63 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.32 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.4 m -79.44 -27.75 41.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -57.98 -35.25 70.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.5 m -74.66 -4.36 36.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.332 179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -100.23 1.21 41.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.135 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.836 HD12 ' HA ' ' A' ' 68' ' ' ARG . 59.1 mt -64.98 144.38 14.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.834 0.349 . . . . 0.0 111.019 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -65.19 -38.83 91.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.164 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.564 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -81.76 126.54 31.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.019 -179.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 66' ' ' VAL . 0.0 OUTLIER -69.89 -39.83 76.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.004 0.43 . . . . 0.0 110.501 179.838 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.451 ' N ' ' HG3' ' A' ' 65' ' ' ARG . 21.6 t -67.48 -39.66 82.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.113 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.904 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.7 OUTLIER -70.39 -45.05 66.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.965 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.836 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.5 OUTLIER -58.17 -33.07 68.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.024 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 7.0 mt -74.67 -44.24 51.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.1 t -64.2 -35.43 80.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.159 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.904 HG23 ' O ' ' A' ' 67' ' ' ASN . 24.6 t -67.94 -53.47 29.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.231 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.544 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 6.2 mt -59.17 -30.01 67.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.38 -55.82 28.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.497 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.732 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.39 -44.44 92.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.858 0.361 . . . . 0.0 110.974 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.981 HG23 HD12 ' A' ' 52' ' ' LEU . 61.0 mt -60.09 -43.73 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.4 m -57.92 -31.82 67.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.692 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 m -78.36 -42.37 30.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.717 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 74' ' ' ALA . 24.0 t -54.89 -50.33 62.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.09 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.605 ' OE1' HG22 ' A' ' 75' ' ' ILE . 1.2 mp0 -57.21 -44.5 83.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.711 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.12 -27.82 68.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.858 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.428 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 7.2 mmp_? -82.66 -41.58 19.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.056 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.57 -36.21 83.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.27 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.676 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -66.26 -3.32 5.58 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.764 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.676 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -99.43 -10.04 22.69 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.895 0.379 . . . . 0.0 110.224 178.324 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.496 ' O ' HG21 ' A' ' 45' ' ' ILE . 2.3 m-85 -114.24 116.24 28.71 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.511 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -71.84 -25.76 62.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.803 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.67 174.57 15.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.834 HG13 ' HB2' ' A' ' 93' ' ' LEU . 38.2 t -83.69 130.73 54.52 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.839 -0.164 . . . . 0.0 110.806 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 99.7 Cg_exo -43.31 164.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.544 2.163 . . . . 0.0 112.463 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.0 -27.82 47.05 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.656 2.238 . . . . 0.0 112.382 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 11.4 m-20 -100.45 -39.32 8.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.617 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.48 172.85 26.14 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.261 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.834 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -121.58 122.66 40.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 117.108 0.454 . . . . 0.0 111.093 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.679 ' CG2' HG23 ' A' ' 38' ' ' ILE . 55.8 t -135.96 111.44 11.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.341 179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.683 HG23 HD11 ' A' ' 93' ' ' LEU . 43.7 t -116.02 149.58 18.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-85 -132.3 130.1 40.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.078 0.466 . . . . 0.0 111.212 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 91.2 m -139.07 131.44 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.615 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.34 168.55 40.99 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 91.6 m -114.86 112.8 23.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.775 0.321 . . . . 0.0 110.751 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.669 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.6 pp -111.83 170.96 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.161 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 18.9 t -121.97 149.53 25.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.412 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.526 HG21 ' NZ ' ' A' ' 108' ' ' LYS . 73.3 p -104.68 162.38 13.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.288 179.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -38.03 43.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.048 0.452 . . . . 0.0 110.405 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -63.91 -14.56 54.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.51 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 96.54 -5.19 64.56 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.004 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.9 mtpt -81.42 134.31 35.53 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.939 0.4 . . . . 0.0 110.798 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -92.31 118.6 31.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.794 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.526 ' NZ ' HG21 ' A' ' 102' ' ' THR . 25.8 mtmm -117.44 122.11 42.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -74.04 140.3 45.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.98 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 21.7 t -115.89 106.99 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.108 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.4 ' HB2' ' NH1' ' A' ' 81' ' ' ARG . 1.3 m120 -116.19 110.63 19.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.317 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.618 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -128.59 141.82 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.966 0.412 . . . . 0.0 112.002 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -136.96 132.36 34.28 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.443 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -169.71 170.34 8.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.961 0.41 . . . . 0.0 111.409 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -93.4 138.56 22.98 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.633 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.443 ' HG3' HG23 ' A' ' 94' ' ' VAL . 39.1 Cg_exo -56.55 168.39 2.24 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.744 2.296 . . . . 0.0 112.837 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.832 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -65.44 -40.01 92.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.742 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 29.2 mttt -140.8 165.63 28.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.481 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.53 ' O ' HD13 ' A' ' 120' ' ' ILE . 32.2 Cg_exo -58.58 132.62 49.32 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.271 1.98 . . . . 0.0 112.307 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.53 HD13 ' O ' ' A' ' 119' ' ' PRO . 28.5 mm -128.31 112.55 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.363 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.11 46.2 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.797 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.0 m -154.66 111.92 3.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.524 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 8.3 p -79.0 111.86 15.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.664 HD22 HD12 ' A' ' 126' ' ' LEU . 1.1 tt -108.6 122.97 48.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.406 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.496 ' N ' HD23 ' A' ' 124' ' ' LEU . 9.9 t80 -130.34 117.74 20.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.374 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.664 HD12 HD22 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -151.67 152.2 32.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.459 0.647 . . . . 0.0 112.485 -179.115 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 4.2 t -125.01 129.81 51.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.898 -1.047 . . . . 0.0 109.948 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -154.45 -163.14 1.53 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.802 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.639 ' CG ' HG22 ' A' ' 32' ' ' THR . 5.5 m-80 -81.07 4.88 18.32 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.496 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.74 161.84 7.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.701 0.286 . . . . 0.0 110.543 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.488 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 59.9 m-85 -70.44 149.06 47.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.28 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -110.87 93.24 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.012 0.434 . . . . 0.0 110.948 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.619 HG22 HD12 ' A' ' 136' ' ' LEU . 37.5 p -79.46 59.42 2.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.943 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 8.0 mm-40 -73.7 -54.06 8.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.671 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.59 -25.99 61.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.195 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.644 ' O ' HD22 ' A' ' 139' ' ' LEU . 77.7 mt -79.89 -50.13 10.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.663 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 3.8 m -79.05 -4.46 50.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.571 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.51 -35.83 78.04 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -72.0 -57.68 4.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.488 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -55.99 -40.61 73.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.08 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 22.5 t -71.95 -31.4 66.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.885 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.921 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.4 mmm . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 168.37 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.17 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.31 -26.8 28.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.051 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -58.47 146.61 72.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.699 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -55.18 -74.63 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.328 2.019 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.7 p -163.06 140.49 7.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.87 0.367 . . . . 0.0 111.153 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.16 -39.79 10.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.953 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.57 -30.18 71.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.57 -36.05 78.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.819 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.423 ' O ' ' CZ ' ' A' ' 117' ' ' PHE . 16.9 mtt180 -49.17 -30.45 6.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.237 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 14' ' ' ILE . 11.1 m120 -74.83 -40.8 60.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.689 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 15' ' ' TRP . 23.9 t -58.98 -37.15 65.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.47 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.549 ' O ' HD12 ' A' ' 17' ' ' ILE . 3.8 mt-10 -60.61 -40.51 92.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.774 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.0 OUTLIER -60.75 -30.62 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.115 178.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' A' ' 12' ' ' VAL . 8.4 t-105 -73.89 -45.09 52.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.838 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -73.56 -45.29 54.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.228 0.537 . . . . 0.0 109.828 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.549 HD12 ' O ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -61.16 -33.84 57.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.482 179.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.5 ttmm -63.07 -45.62 91.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.504 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -78.03 -29.99 49.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.897 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -55.21 21.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.479 HG23 ' O ' ' A' ' 17' ' ' ILE . 15.6 pt -53.33 -48.64 55.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.006 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.466 ' N ' HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -50.57 -35.61 30.78 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.884 0.373 . . . . 0.0 111.15 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 m -78.34 -36.18 46.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.764 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 131' ' ' PHE . 57.7 mt -78.59 -36.12 44.77 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -58.49 -35.95 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.283 . . . . 0.0 111.419 -179.339 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.64 -6.09 59.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.439 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.955 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.76 126.51 32.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.847 0.356 . . . . 0.0 111.021 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 mmt-85 -143.71 131.95 21.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.085 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -108.34 176.22 20.14 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.396 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -114.08 92.83 4.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.793 0.33 . . . . 0.0 111.392 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.61 31.41 3.71 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.531 -0.842 . . . . 0.0 112.807 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.772 HG23 ' HA ' ' A' ' 128' ' ' ASP . 2.0 m 72.72 71.55 0.14 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.05 0.452 . . . . 0.0 110.401 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' MET . 1.8 m -108.88 29.45 7.45 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.851 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.496 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -135.8 113.69 11.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.479 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.62 HG21 HG21 ' A' ' 78' ' ' VAL . 34.2 mt -105.7 120.54 56.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.004 0.431 . . . . 0.0 111.278 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.448 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 1.8 m -109.83 121.25 44.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.499 178.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.74 HD21 HG11 ' A' ' 48' ' ' VAL . 7.8 tp -131.2 127.24 37.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.846 0.355 . . . . 0.0 111.871 -178.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.641 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.9 mp -123.93 123.9 67.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.281 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.775 HG12 HG21 ' A' ' 48' ' ' VAL . 10.2 mt -116.48 136.75 23.18 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.558 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.568 ' O ' HG11 ' A' ' 88' ' ' VAL . 31.2 Cg_exo -58.91 156.06 35.29 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.642 2.228 . . . . 0.0 112.303 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.91 -39.08 43.33 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.645 2.23 . . . . 0.0 112.547 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -16.21 49.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.369 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.15 162.76 24.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.665 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -105.84 145.1 31.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.861 0.362 . . . . 0.0 110.856 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.8 mm -57.14 -53.89 37.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.557 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.601 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -54.84 -31.94 59.98 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.926 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.67 -53.86 41.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.775 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -59.45 -23.59 25.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.972 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -54.16 -31.06 51.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 111.018 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm -76.88 -50.44 13.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.455 ' HE2' ' HB3' ' A' ' 51' ' ' MET . 0.0 OUTLIER -58.45 -44.45 89.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.948 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.18 -56.98 6.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.509 179.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.12 -30.61 16.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.678 179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -62.37 -42.8 99.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -79.53 -23.14 43.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.84 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.813 ' HB2' HG21 ' A' ' 75' ' ' ILE . 81.5 t80 -64.67 -44.67 89.63 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.638 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -67.02 -44.98 87.03 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.56 -0.829 . . . . 0.0 112.463 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.6 m -67.72 -28.6 67.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.802 0.334 . . . . 0.0 110.871 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.17 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.103 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.625 ' OG ' HD11 ' A' ' 72' ' ' LEU . 2.6 m -79.99 -2.37 43.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.241 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -104.1 1.24 30.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.458 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 68' ' ' ARG . 68.4 mt -64.81 144.68 14.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.382 . . . . 0.0 110.907 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -36.04 69.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.573 ' H ' HG22 ' A' ' 62' ' ' ILE . 4.3 t -75.5 133.73 40.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.955 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -71.82 -55.33 7.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.02 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.54 -33.33 54.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.498 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.892 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.7 t-20 -74.39 -52.42 12.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.059 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.752 ' HA ' HD12 ' A' ' 62' ' ' ILE . 1.4 ppt_? -55.57 -35.1 65.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.986 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.571 HD21 ' NH2' ' A' ' 68' ' ' ARG . 16.4 mt -74.81 -47.91 28.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.85 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 9.5 t -59.05 -28.46 66.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.155 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 67' ' ' ASN . 32.7 t -76.69 -53.71 14.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.625 HD11 ' OG ' ' A' ' 60' ' ' SER . 81.8 mt -59.33 -40.45 86.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.793 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.99 96.96 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.377 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -68.54 -48.25 64.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.795 0.331 . . . . 0.0 110.91 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.948 HG23 HD12 ' A' ' 52' ' ' LEU . 82.5 mt -58.27 -42.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 94.6 m -56.96 -31.55 65.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.564 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 5.7 m -76.38 -39.73 52.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.501 179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 HG21 ' A' ' 35' ' ' ILE . 35.4 t -56.44 -48.43 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.888 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -60.1 -40.77 90.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.403 179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 83' ' ' LYS . 21.0 mm-40 -61.31 -27.9 68.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.535 179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -82.84 -39.57 21.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.055 179.7 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.35 -33.24 75.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.451 -179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.674 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -69.15 -6.32 27.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.557 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.674 HD23 ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -96.17 -7.81 34.82 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 110.197 178.482 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -118.87 113.48 21.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.6 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -71.76 -23.89 61.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.964 0.411 . . . . 0.0 110.659 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.39 169.32 24.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.772 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.839 HG13 ' HB2' ' A' ' 93' ' ' LEU . 64.2 t -82.64 132.79 50.87 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.584 0.23 . . . . 0.0 111.321 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 96.7 Cg_exo -44.9 164.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.768 2.312 . . . . 0.0 112.596 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.03 -36.21 64.29 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.771 2.314 . . . . 0.0 112.297 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 5.8 m-20 -90.77 -40.01 12.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.442 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.86 177.63 32.12 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.27 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.839 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.1 tm? -124.76 120.96 33.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.92 0.391 . . . . 0.0 110.746 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 38' ' ' ILE . 96.5 t -136.13 112.2 12.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.693 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.4 t -116.22 149.19 18.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.483 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 21.8 m-30 -130.12 116.72 18.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.019 0.438 . . . . 0.0 110.864 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -127.38 130.07 48.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.334 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.46 168.67 41.12 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.262 -0.97 . . . . 0.0 112.962 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.1 m -116.92 112.85 21.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.394 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.955 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.7 pp -112.98 175.31 2.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.476 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 t -121.87 148.75 25.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.328 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 74.2 p -104.75 161.24 14.32 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.274 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -51.61 -35.73 42.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.068 0.461 . . . . 0.0 110.352 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -65.46 -14.53 61.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 93.86 10.52 58.75 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.836 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -97.64 134.35 40.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.774 0.321 . . . . 0.0 110.705 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.76 118.53 29.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.81 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 100' ' ' ILE . 6.1 mtpt -120.47 121.43 38.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.829 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 140.51 44.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.354 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.445 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 22.8 t -114.59 107.0 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.983 179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -117.01 110.66 18.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.764 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -131.36 141.72 45.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.552 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.42 ' CB ' HG22 ' A' ' 95' ' ' VAL . 2.4 p30 -135.74 131.96 36.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.218 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.596 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 13.2 p90 -169.76 170.25 8.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.028 0.442 . . . . 0.0 111.605 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 1.8 pm0 -90.35 145.26 32.27 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.204 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.36 168.1 11.79 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.492 2.128 . . . . 0.0 112.849 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.774 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -57.56 -40.94 80.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.928 -179.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.0 OUTLIER -145.96 165.22 21.52 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.348 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.706 ' O ' HD13 ' A' ' 120' ' ' ILE . 50.8 Cg_exo -54.41 132.55 51.55 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.069 1.846 . . . . 0.0 112.217 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.706 HD13 ' O ' ' A' ' 119' ' ' PRO . 23.9 mm -128.44 112.64 27.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.468 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -87.67 46.23 1.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.723 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 79.5 m -154.74 112.13 3.39 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.298 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.426 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 9.7 p -83.07 112.27 19.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.799 0.333 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.595 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -114.61 126.33 54.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.617 -179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.595 ' N ' HD23 ' A' ' 124' ' ' LEU . 52.6 t80 -130.32 122.77 28.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.179 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.63 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -150.43 152.07 33.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.356 0.598 . . . . 0.0 112.233 -179.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.581 ' SG ' HG22 ' A' ' 32' ' ' THR . 1.9 t -124.07 128.76 49.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.063 -0.972 . . . . 0.0 109.692 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' THR . 2.3 t70 -155.92 -177.35 6.51 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.011 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.416 ' C ' ' HG3' ' A' ' 34' ' ' MET . 28.9 m-80 -76.25 0.87 17.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.714 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.63 145.42 22.46 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.723 0.296 . . . . 0.0 110.98 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.496 ' CZ ' ' HE2' ' A' ' 34' ' ' MET . 64.1 m-85 -64.62 125.37 24.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.694 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.486 ' HB2' HD21 ' A' ' 126' ' ' LEU . 12.7 m-70 -92.73 97.63 10.9 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.749 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.026 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -88.97 51.65 2.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.016 -179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.671 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 1.8 pp20? -67.57 -36.06 80.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.713 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.605 ' HB2' ' OE2' ' A' ' 134' ' ' GLU . . . -75.65 -35.38 60.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.993 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.026 HD12 HG22 ' A' ' 133' ' ' THR . 61.8 mt -79.84 -51.87 8.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.563 179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.6 m -64.67 -17.98 64.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.815 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.73 -27.78 65.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.441 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' HB3' ' A' ' 117' ' ' PHE . 0.8 OUTLIER -79.58 -56.75 4.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.38 . . . . 0.0 110.642 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -56.95 -40.76 77.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.993 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 51.3 m -72.01 -33.63 68.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.848 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG3' ' N ' ' A' ' 2' ' ' ALA . 3.4 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.091 0.472 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.523 ' N ' ' HG3' ' A' ' 1' ' ' MET . . . -87.91 168.33 12.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.472 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -84.27 -26.87 28.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.863 179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -115.33 149.95 43.66 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -67.29 -95.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.351 2.034 . . . . 0.0 112.043 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.1 p -155.33 150.13 26.5 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.914 0.387 . . . . 0.0 111.297 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.7 -53.24 3.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.862 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.52 -29.0 70.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.839 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -64.23 -34.77 78.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -49.38 -30.43 7.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.98 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.721 ' O ' HG22 ' A' ' 14' ' ' ILE . 33.3 m120 -79.13 -40.16 31.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.98 0.419 . . . . 0.0 110.392 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.92 -34.45 64.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.278 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -69.77 -39.43 76.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.895 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -60.84 -28.69 43.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.865 178.736 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.458 ' CE2' ' HD2' ' A' ' 19' ' ' LYS . 9.6 t-105 -72.85 -45.27 59.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.631 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -72.66 -45.31 59.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.195 0.522 . . . . 0.0 109.759 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.5 mt -61.97 -38.71 81.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.356 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 14' ' ' ILE . 15.8 ttmm -58.86 -42.36 89.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.161 0.505 . . . . 0.0 110.029 179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 15' ' ' TRP . 14.7 mtpp -79.91 -30.2 40.01 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.505 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 114' ' ' PHE . 13.3 tp -59.96 -58.35 8.93 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.893 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.717 ' HA ' HD12 ' A' ' 24' ' ' LEU . 2.4 pp -51.47 -39.81 23.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.889 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.659 ' N ' HD12 ' A' ' 21' ' ' ILE . 36.6 mmtm -55.63 -46.26 77.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.094 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.9 m -57.63 -32.06 66.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.352 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.717 HD12 ' HA ' ' A' ' 21' ' ' ILE . 6.2 mt -78.17 -38.32 43.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG3' ' HA ' ' A' ' 22' ' ' LYS . 3.1 mt-10 -59.53 -25.48 64.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.036 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.99 36.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.888 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.013 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -83.99 127.53 33.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.978 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.86 134.19 27.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.077 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -115.41 170.86 13.44 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.281 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.09 99.46 7.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.643 0.259 . . . . 0.0 111.44 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . 107.86 31.84 3.51 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.038 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 31' ' ' GLY . 2.5 p 69.65 63.26 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.391 0.615 . . . . 0.0 110.477 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.4 ' O ' ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -104.48 29.29 6.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.358 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.451 ' HE2' ' HA ' ' A' ' 34' ' ' MET . 1.0 OUTLIER -133.64 114.14 13.16 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.992 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.629 HD12 ' CB ' ' A' ' 74' ' ' ALA . 14.8 mt -108.49 121.33 61.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.577 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 0.5 OUTLIER -108.2 121.81 45.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.47 178.548 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.413 HD22 HG11 ' A' ' 78' ' ' VAL . 25.8 tp -129.17 125.19 36.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.947 0.403 . . . . 0.0 111.517 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.601 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.4 mp -123.85 123.54 67.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.644 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.2 mt -115.18 136.92 22.72 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.293 -179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.587 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.6 Cg_exo -59.52 155.94 39.22 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.497 2.131 . . . . 0.0 112.384 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -64.83 -39.02 27.34 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.644 2.23 . . . . 0.0 112.497 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -82.06 -14.51 55.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.307 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.45 163.81 27.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.528 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -108.28 145.89 33.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.79 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.453 HG23 HD22 ' A' ' 82' ' ' LEU . 21.1 mm -56.89 -53.82 37.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.635 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 19.7 t -56.8 -31.4 64.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.812 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -57.13 12.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.621 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 1.9 t -59.74 -24.0 27.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.816 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.635 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -50.6 -30.06 12.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.021 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.5 -50.7 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.655 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.487 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -57.63 -45.07 85.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.635 179.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.758 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.14 -57.42 5.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.527 179.645 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.21 -30.84 18.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.724 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -63.43 -39.68 95.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.591 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -82.89 -23.32 33.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.957 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.877 ' HB2' HG21 ' A' ' 75' ' ' ILE . 66.5 t80 -67.98 -40.22 83.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.728 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.84 -39.46 59.48 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.264 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.9 m -70.11 -27.46 64.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.819 0.342 . . . . 0.0 110.711 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.51 ' HB3' ' CD2' ' A' ' 72' ' ' LEU . . . -60.95 -28.81 69.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 m -75.75 -6.38 50.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.268 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -100.94 1.58 39.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.333 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.694 HD13 HD22 ' A' ' 67' ' ' ASN . 35.7 mt -65.24 145.78 13.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -77.23 -33.16 56.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.95 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.0 OUTLIER -79.37 135.88 36.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.952 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.53 ' HD2' HD23 ' A' ' 69' ' ' LEU . 12.6 tpt180 -71.83 -52.61 16.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.088 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.4 t -60.64 -37.74 76.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.584 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.819 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.6 OUTLIER -63.59 -51.58 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.066 -179.722 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.658 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.0 OUTLIER -60.48 -54.29 47.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.582 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.617 HD22 ' HG2' ' A' ' 68' ' ' ARG . 4.2 mm? -58.38 -30.76 67.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.3 t -74.89 -33.02 61.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 67' ' ' ASN . 35.8 t -84.83 -53.54 10.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 59' ' ' ALA . 67.0 mt -54.05 -47.17 71.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.93 -46.31 91.84 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.541 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.629 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -62.14 -49.35 76.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.877 HG21 ' HB2' ' A' ' 56' ' ' PHE . 84.7 mt -57.87 -39.82 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.756 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.7 m -56.67 -33.31 66.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.65 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.4 m -76.73 -39.1 52.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.649 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 74' ' ' ALA . 34.7 t -57.71 -57.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.006 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -57.12 -34.83 68.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 13.8 mm-40 -56.74 -40.56 75.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.478 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.474 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.453 HD22 HG23 ' A' ' 45' ' ' ILE . 46.1 mt -63.68 -37.52 87.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.447 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' GLN . 3.3 pttp -64.81 -10.5 28.46 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mt -98.2 -15.66 19.78 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.887 0.375 . . . . 0.0 110.248 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -111.63 109.72 19.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.469 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.88 -24.07 61.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 111.025 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -157.58 168.89 25.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.956 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.843 HG13 ' HB2' ' A' ' 93' ' ' LEU . 58.9 t -81.18 132.99 54.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.565 0.221 . . . . 0.0 111.274 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.412 ' CB ' ' HB3' ' A' ' 115' ' ' GLU . 87.9 Cg_exo -48.02 164.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.633 2.222 . . . . 0.0 112.658 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.09 -40.77 41.62 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.744 2.296 . . . . 0.0 112.608 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 7.5 m-20 -87.14 -40.09 14.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.459 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 157.78 177.5 30.95 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.585 -0.817 . . . . 0.0 111.681 -179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.843 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.0 tm? -125.15 119.5 28.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.905 0.383 . . . . 0.0 110.794 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.601 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.9 t -135.31 112.05 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.769 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 112' ' ' ILE . 48.0 t -115.41 147.78 18.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.523 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.0 m-30 -128.63 117.64 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.045 0.45 . . . . 0.0 110.936 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 84.7 m -128.41 129.68 46.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.705 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 33' ' ' SER . . . -168.09 168.5 40.84 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.827 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 45.9 m -110.67 112.9 25.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.735 0.302 . . . . 0.0 110.747 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 1.013 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.8 pp -113.33 168.67 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.245 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.6 t -120.85 146.84 25.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.402 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -104.87 163.26 12.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.276 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -52.24 -34.45 46.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.452 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -62.69 -14.63 46.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.681 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.98 20.86 52.3 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.62 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -108.31 139.8 42.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 110.642 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -88.18 118.42 27.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.6 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -121.62 121.44 37.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.075 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -72.87 140.29 47.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.446 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 25.7 t -118.57 106.89 20.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -116.4 110.52 18.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.692 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.65 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.8 mt -127.02 139.86 50.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.488 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.433 ' CB ' HG22 ' A' ' 95' ' ' VAL . 11.0 p30 -136.62 134.19 37.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.363 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.601 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 14.9 p90 -169.49 170.19 8.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 111.616 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 2.1 pm0 -93.35 139.19 22.87 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.278 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.477 ' HG3' HG23 ' A' ' 94' ' ' VAL . 48.6 Cg_exo -54.53 162.04 5.09 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.387 2.058 . . . . 0.0 112.614 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.895 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 28.4 t80 -59.61 -37.36 78.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.608 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -143.05 164.78 29.8 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.006 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.675 ' O ' HD13 ' A' ' 120' ' ' ILE . 15.2 Cg_endo -57.6 132.34 49.8 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 121.959 1.773 . . . . 0.0 112.038 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.675 HD13 ' O ' ' A' ' 119' ' ' PRO . 27.8 mm -128.46 112.66 27.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.553 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -89.06 45.71 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.666 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m -153.08 112.06 3.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.759 0.314 . . . . 0.0 111.45 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.449 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -81.64 108.88 15.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.117 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.616 HD23 ' N ' ' A' ' 125' ' ' TYR . 1.3 tt -112.04 125.69 54.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.436 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.616 ' N ' HD23 ' A' ' 124' ' ' LEU . 19.0 t80 -130.38 121.19 25.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.32 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.16 152.32 33.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.459 0.647 . . . . 0.0 112.4 -179.262 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 48.8 t -123.67 127.54 48.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.682 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.21 -176.05 5.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.036 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.435 ' C ' ' HG3' ' A' ' 34' ' ' MET . 7.2 m120 -76.93 0.42 21.1 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.573 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -156.65 147.15 21.5 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.767 0.318 . . . . 0.0 110.745 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.523 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 63.8 m-85 -65.4 125.3 24.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.582 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -90.18 101.71 14.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.932 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.036 HG22 HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -93.94 45.11 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.916 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 2.9 mt-10 -66.62 -48.01 70.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.535 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.92 -27.36 68.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.103 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.036 HD12 HG22 ' A' ' 133' ' ' THR . 38.6 mt -78.69 -46.84 18.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.94 0.4 . . . . 0.0 110.881 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.2 m -81.27 -15.84 54.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.935 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -58.34 -37.3 74.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -56.83 -56.11 25.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.833 -179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.412 ' HA ' HD13 ' A' ' 140' ' ' LEU . 3.8 mm? -61.68 -31.95 72.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.963 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -31.42 57.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.901 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.805 0.336 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.95 165.38 15.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.135 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -84.46 -24.02 29.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.851 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' PRO . 7.9 m-20 -55.27 150.31 22.83 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.41 ' O ' ' O ' ' A' ' 4' ' ' ASP . 48.4 Cg_exo -56.06 -143.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 122.86 2.374 . . . . 0.0 112.453 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.401 ' HB2' ' HB3' ' A' ' 9' ' ' ASP . 25.8 p -92.89 89.15 6.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.805 0.336 . . . . 0.0 110.935 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.87 -82.93 0.07 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.921 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.84 -25.64 68.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.849 0.357 . . . . 0.0 111.017 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 6' ' ' SER . 0.2 OUTLIER -66.97 -35.38 79.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.947 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 11.6 mmm-85 -51.12 -30.73 17.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.279 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.666 ' O ' HG22 ' A' ' 14' ' ' ILE . 14.8 m120 -74.37 -42.44 59.31 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 0.0 110.511 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.6 t -63.58 -36.53 76.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' O ' HD12 ' A' ' 17' ' ' ILE . 2.3 mm-40 -65.31 -38.95 91.76 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.711 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.2 OUTLIER -61.19 -29.07 45.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.979 178.772 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.486 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.0 t-105 -74.42 -44.92 49.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.673 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.87 -45.39 51.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.235 0.541 . . . . 0.0 109.618 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.421 HD12 ' O ' ' A' ' 13' ' ' GLU . 2.1 mt -59.73 -37.73 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.363 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 ttmm -60.71 -42.77 97.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.226 0.536 . . . . 0.0 109.816 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 24.7 mtpt -79.54 -27.12 41.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.819 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.44 ' CD2' ' CE2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -72.28 -52.48 16.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.102 -179.664 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.84 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.0 pt -53.27 -48.21 55.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.2 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.439 ' N ' HG13 ' A' ' 21' ' ' ILE . 30.9 mmtm -56.37 -35.91 68.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.18 -32.63 74.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.975 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 21' ' ' ILE . 2.5 mt -78.64 -38.07 40.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.985 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.64 -26.9 67.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.027 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -86.62 -14.5 42.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.306 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -84.75 126.4 33.38 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.856 0.36 . . . . 0.0 111.04 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -139.4 133.0 30.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.981 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' HA3' ' HB3' ' A' ' 33' ' ' SER . . . -109.13 175.72 19.29 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.484 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.05 95.94 5.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.712 0.291 . . . . 0.0 111.255 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.22 31.64 4.93 Favored Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.76 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.821 HG23 ' HA ' ' A' ' 128' ' ' ASP . 1.5 m 75.29 70.81 0.09 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.145 0.498 . . . . 0.0 110.213 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -109.1 29.41 7.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.87 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.48 ' HE2' ' CZ ' ' A' ' 131' ' ' PHE . 0.9 OUTLIER -136.07 114.6 11.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.222 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.58 HD12 ' CB ' ' A' ' 74' ' ' ALA . 18.2 mt -107.26 120.91 59.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.368 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.472 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 3.1 t -109.18 122.52 47.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.572 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.653 HD21 HG11 ' A' ' 48' ' ' VAL . 31.1 tp -128.74 120.51 26.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.935 0.398 . . . . 0.0 111.772 -178.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' ' 94' ' ' VAL . 3.5 mp -116.5 120.31 64.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.342 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.67 HG12 HG21 ' A' ' 48' ' ' VAL . 12.1 mt -115.18 137.53 23.04 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.61 ' O ' HG11 ' A' ' 88' ' ' VAL . 33.0 Cg_exo -60.8 156.35 43.8 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.715 2.277 . . . . 0.0 112.295 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.51 -39.04 17.41 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.702 2.268 . . . . 0.0 112.718 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -14.34 54.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.485 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.72 167.98 17.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.734 0.302 . . . . 0.0 110.569 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.09 145.15 37.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.806 HG23 HD22 ' A' ' 82' ' ' LEU . 19.1 mm -56.67 -53.88 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.609 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.621 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 27.8 m -55.19 -31.37 61.35 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -56.12 20.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.707 179.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.67 HG21 HG12 ' A' ' 39' ' ' ILE . 1.3 t -58.34 -23.64 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.942 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -52.73 -30.68 33.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.011 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.63 -52.34 10.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -43.97 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.715 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.889 HD12 HG23 ' A' ' 75' ' ' ILE . 0.1 OUTLIER -69.47 -57.27 5.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.61 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.02 -29.64 13.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.755 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -62.18 -40.92 97.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.467 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -81.09 -21.91 39.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.936 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.834 ' HB2' HG21 ' A' ' 75' ' ' ILE . 84.0 t80 -67.33 -42.71 83.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.827 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.6 -43.49 52.28 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.423 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -68.49 -27.42 66.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.895 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.438 ' HB1' ' HB ' ' A' ' 71' ' ' VAL . . . -59.55 -35.37 74.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.054 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.455 ' OG ' HD21 ' A' ' 72' ' ' LEU . 0.7 OUTLIER -75.56 -4.94 42.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.43 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -101.61 2.05 38.44 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.592 0.234 . . . . 0.0 111.411 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 68' ' ' ARG . 58.5 mt -64.85 144.47 14.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.846 0.355 . . . . 0.0 110.982 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.02 -37.08 75.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.745 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.586 ' H ' HG22 ' A' ' 62' ' ' ILE . 20.5 t -71.59 132.7 45.02 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.961 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -56.8 5.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.016 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.43 -32.6 57.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.508 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.874 ' O ' HG23 ' A' ' 71' ' ' VAL . 0.1 OUTLIER -72.57 -48.6 38.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.167 -179.727 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.796 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -58.3 -33.85 69.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.821 0.343 . . . . 0.0 110.991 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.429 ' N ' ' HG3' ' A' ' 68' ' ' ARG . 13.1 mt -74.74 -48.28 26.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.842 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -58.04 -30.34 66.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.136 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.874 HG23 ' O ' ' A' ' 67' ' ' ASN . 30.3 t -74.68 -53.67 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.963 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.455 HD21 ' OG ' ' A' ' 60' ' ' SER . 90.8 mt -59.8 -37.81 80.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.877 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.85 -51.82 54.65 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.472 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.58 ' CB ' HD12 ' A' ' 35' ' ' ILE . . . -61.53 -48.11 82.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.871 0.367 . . . . 0.0 110.998 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.889 HG23 HD12 ' A' ' 52' ' ' LEU . 91.8 mt -57.69 -40.38 75.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.801 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 93.5 m -58.18 -31.69 67.52 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.439 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -78.51 -42.29 29.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.637 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.566 HG21 HG21 ' A' ' 35' ' ' ILE . 35.8 t -51.12 -48.12 31.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.875 0.369 . . . . 0.0 110.685 179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.482 ' O ' ' HD2' ' A' ' 83' ' ' LYS . 1.2 mp0 -63.51 -43.04 98.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.394 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -50.58 -30.78 14.04 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.01 0.433 . . . . 0.0 110.643 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -34.7 31.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.996 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.806 HD22 HG23 ' A' ' 45' ' ' ILE . 32.5 mt -60.94 -34.47 74.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.596 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -70.15 -9.8 56.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.305 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.61 -18.12 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.199 178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -121.22 116.88 25.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.453 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -71.85 -43.65 65.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.982 0.42 . . . . 0.0 110.488 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.23 170.46 15.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.59 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.847 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.3 t -80.27 132.4 59.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.59 0.233 . . . . 0.0 111.188 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 83.1 Cg_exo -46.67 164.99 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.669 2.246 . . . . 0.0 112.586 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -51.18 -39.9 61.03 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.78 2.32 . . . . 0.0 112.309 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 119' ' ' PRO . 4.5 m-20 -86.62 -38.86 16.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.06 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.42 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.11 -177.44 33.98 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.725 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.847 ' HB2' HG13 ' A' ' 88' ' ' VAL . 2.9 tm? -129.56 118.87 22.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.015 0.436 . . . . 0.0 110.771 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.761 HG22 ' HA ' ' A' ' 38' ' ' ILE . 65.6 t -135.02 112.06 14.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.41 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.677 HG22 ' CB ' ' A' ' 113' ' ' ASP . 29.6 t -116.09 148.55 18.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.49 ' HB3' ' CE1' ' A' ' 131' ' ' PHE . 22.2 m-30 -129.41 120.42 25.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.97 0.414 . . . . 0.0 110.815 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 88.2 m -132.61 131.35 41.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.08 168.54 40.87 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.512 -0.851 . . . . 0.0 112.868 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.0 m -115.97 113.14 22.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.765 0.317 . . . . 0.0 110.466 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' A' ' 27' ' ' ALA . 2.4 pp -109.89 171.14 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.021 0.439 . . . . 0.0 111.266 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.0 t -118.53 144.7 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.218 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 72.8 p -104.72 161.47 14.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.346 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -52.11 -30.13 24.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.035 0.445 . . . . 0.0 110.479 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -66.05 -14.04 61.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.56 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.54 18.78 54.28 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.356 -0.926 . . . . 0.0 112.647 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 mtpp -110.57 143.18 41.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.812 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.16 118.61 30.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.636 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.7 mtpt -117.15 121.47 41.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.926 0.393 . . . . 0.0 111.046 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -73.37 140.36 46.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.3 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 34.3 t -119.0 106.9 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.607 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -116.59 110.32 18.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.961 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -127.59 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.941 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.677 ' CB ' HG22 ' A' ' 95' ' ' VAL . 1.1 p30 -138.04 131.92 31.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.556 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.483 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 17.3 p90 -169.68 170.09 8.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.962 0.41 . . . . 0.0 111.426 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.96 142.16 27.22 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.324 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.489 ' CB ' HD11 ' A' ' 120' ' ' ILE . 17.0 Cg_endo -57.73 168.05 3.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.56 2.173 . . . . 0.0 112.404 -179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 2.4 t80 -64.08 -38.23 90.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.966 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 8.8 mtmt -139.87 169.25 12.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.779 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 91' ' ' ASN . 51.8 Cg_exo -52.88 141.42 55.64 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.377 2.051 . . . . 0.0 112.313 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.71 HG22 ' H ' ' A' ' 122' ' ' THR . 19.4 mm -103.98 153.1 6.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.745 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -136.95 16.86 3.04 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.895 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.71 ' H ' HG22 ' A' ' 120' ' ' ILE . 9.8 m -155.79 112.09 3.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.637 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.4 ' CB ' ' HD3' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -75.55 109.8 9.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.305 179.325 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.614 HD22 HD12 ' A' ' 126' ' ' LEU . 1.4 tt -114.57 128.28 56.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.024 0.44 . . . . 0.0 111.775 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.607 ' N ' HD23 ' A' ' 124' ' ' LEU . 13.1 t80 -130.42 122.01 26.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.174 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.625 HD22 ' C ' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -151.66 152.3 32.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.541 0.686 . . . . 0.0 112.576 -179.163 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' HG22 ' A' ' 32' ' ' THR . 4.4 t -124.67 128.92 49.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.527 178.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.821 ' HA ' HG23 ' A' ' 32' ' ' THR . 1.7 t70 -154.32 -175.94 5.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.094 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.424 ' C ' ' HG3' ' A' ' 34' ' ' MET . 3.0 m-80 -76.98 0.29 21.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.754 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.24 145.66 22.02 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.777 0.322 . . . . 0.0 110.974 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 96' ' ' TYR . 69.5 m-85 -65.35 126.26 27.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.723 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -91.54 106.03 18.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.905 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 0.796 HG22 HD12 ' A' ' 136' ' ' LEU . 8.0 p -94.29 44.51 1.12 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.96 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 10.1 mt-10 -62.67 -54.05 45.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.614 179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.91 63.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.091 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.796 HD12 HG22 ' A' ' 133' ' ' THR . 16.5 mt -78.98 -48.42 14.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.976 0.417 . . . . 0.0 110.734 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 6.9 m -81.53 0.43 38.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.171 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.16 -27.49 66.47 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.451 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.566 HD22 ' H ' ' A' ' 139' ' ' LEU . 0.3 OUTLIER -74.75 -56.37 4.86 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.749 0.309 . . . . 0.0 110.704 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 140' ' ' LEU . 4.5 mm? -64.08 -40.53 96.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.806 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 6.4 t -69.64 -29.89 67.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.847 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.899 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.79 0.329 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.77 168.11 0.98 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.198 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -88.18 -26.65 22.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.068 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -56.59 150.01 37.58 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.936 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.46 ' HB2' ' H ' ' A' ' 6' ' ' SER . 84.2 Cg_exo -48.59 -108.05 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.973 2.448 . . . . 0.0 112.602 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.46 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 67.3 p -144.49 146.36 32.37 Favored 'General case' 0 C--O 1.231 0.095 0 O-C-N 121.993 -0.442 . . . . 0.0 110.914 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.32 -52.89 3.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.004 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.7 -34.4 78.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -37.03 83.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.775 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' CE1' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -48.3 -30.45 4.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.383 -179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 14' ' ' ILE . 16.8 m120 -79.78 -39.15 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.984 0.421 . . . . 0.0 110.747 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.35 -37.93 75.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.557 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' O ' HD12 ' A' ' 17' ' ' ILE . 7.7 mt-10 -64.18 -40.3 95.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.585 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.922 HD12 ' CZ ' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -61.23 -31.86 51.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.979 179.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.476 ' CD2' ' HD2' ' A' ' 19' ' ' LYS . 9.5 t-105 -69.68 -44.18 70.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.63 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -74.55 -44.67 49.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.143 0.497 . . . . 0.0 109.758 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.4 mt -61.95 -36.27 73.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.298 179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.52 -44.87 96.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.014 0.435 . . . . 0.0 109.967 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' HD2' ' CD2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -78.05 -28.36 48.89 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.812 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -69.34 -48.54 61.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.579 ' HA ' HD12 ' A' ' 24' ' ' LEU . 13.4 pt -59.33 -48.6 86.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.37 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' N ' HG13 ' A' ' 21' ' ' ILE . 1.4 mttt -53.11 -36.04 60.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.385 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -67.87 -34.16 76.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.153 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 21' ' ' ILE . 5.9 mt -78.68 -30.18 46.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.234 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -65.91 -31.24 72.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.275 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -85.88 -19.14 31.0 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.922 ' HB1' HG21 ' A' ' 100' ' ' ILE . . . -82.76 126.7 32.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.299 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.03 130.49 33.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.845 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 100' ' ' ILE . . . -95.07 174.68 32.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.649 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -113.85 101.05 8.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.92 0.391 . . . . 0.0 110.779 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 103.89 25.61 7.11 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.595 HG22 ' CG ' ' A' ' 129' ' ' ASN . 13.5 p 55.52 60.3 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.319 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -106.96 29.08 7.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.978 0.418 . . . . 0.0 110.657 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.484 ' O ' ' HA ' ' A' ' 127' ' ' CYS . 0.5 OUTLIER -106.36 126.09 51.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.727 HG23 ' HE1' ' A' ' 125' ' ' TYR . 25.3 mt -113.51 129.76 68.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.513 ' HA ' ' CD1' ' A' ' 96' ' ' TYR . 5.1 p -111.78 120.74 43.0 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.637 178.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD21 HG11 ' A' ' 48' ' ' VAL . 25.2 tp -129.66 122.11 28.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.668 ' HA ' HG22 ' A' ' 94' ' ' VAL . 4.1 mp -120.9 122.6 68.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.914 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.72 HD12 HD12 ' A' ' 93' ' ' LEU . 15.8 mt -115.51 138.18 23.61 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.618 ' O ' HG11 ' A' ' 88' ' ' VAL . 32.2 Cg_exo -57.62 156.35 27.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.718 2.279 . . . . 0.0 112.29 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.86 -39.28 26.07 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.924 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.75 -17.11 48.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.606 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.46 155.63 37.0 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.665 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.01 146.79 26.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.674 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.4 ' CD1' ' HG ' ' A' ' 93' ' ' LEU . 16.9 mm -56.97 -53.84 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.627 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 44.4 m -56.02 -30.65 62.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.801 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.17 -54.83 34.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.608 HG21 HG12 ' A' ' 39' ' ' ILE . 1.1 t -59.85 -25.24 31.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.776 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 46' ' ' SER . . . -51.29 -32.31 24.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.877 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.53 -48.22 23.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.471 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.436 ' HB3' ' HE2' ' A' ' 51' ' ' MET . 0.0 OUTLIER -59.24 -44.91 92.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.569 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.898 HD12 HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -70.21 -57.61 4.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.39 179.547 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.2 -32.29 23.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.45 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -62.78 -38.09 89.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.385 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.402 ' OE1' ' CE2' ' A' ' 125' ' ' TYR . 8.1 tt0 -82.64 -25.24 33.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.79 179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 75' ' ' ILE . 94.2 t80 -64.61 -43.26 94.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.551 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.96 94.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.055 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -76.3 -27.59 56.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.768 0.318 . . . . 0.0 110.636 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 68' ' ' ARG . . . -60.07 -35.02 74.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.764 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.476 ' HA ' ' CG ' ' A' ' 68' ' ' ARG . 2.7 m -79.18 4.67 14.17 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.219 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -114.16 3.55 15.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.801 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' A' ' 68' ' ' ARG . 83.2 mt -64.73 142.49 16.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.981 0.42 . . . . 0.0 110.964 -179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.457 ' H ' HG22 ' A' ' 62' ' ' ILE . 1.3 t -74.35 123.79 25.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.847 0.356 . . . . 0.0 110.782 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 tpt85 -55.72 -52.18 64.8 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -65.56 -39.01 83.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.597 ' OD1' HD13 ' A' ' 62' ' ' ILE . 51.6 t-20 -63.66 -49.83 71.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.786 ' HA ' HD12 ' A' ' 62' ' ' ILE . 0.1 OUTLIER -53.76 -48.46 69.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.53 -30.5 61.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.793 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -60.74 -35.57 76.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.89 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ASN . 39.6 t -82.37 -43.96 19.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.004 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.28 -37.81 70.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.6 -54.63 35.45 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.69 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.551 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.73 -48.47 81.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.72 0.295 . . . . 0.0 111.156 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.898 HG23 HD12 ' A' ' 52' ' ' LEU . 62.3 mt -57.18 -39.22 65.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.909 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.0 m -60.29 -32.21 70.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.561 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 65.1 m -77.29 -41.33 41.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.8 t -55.01 -52.08 47.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -58.76 -38.64 78.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.685 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -61.78 -29.94 70.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.466 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.463 ' HA ' ' CD1' ' A' ' 84' ' ' LEU . 12.0 mmt180 -82.64 -37.53 24.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.687 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.43 -36.83 85.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.179 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.605 ' HD3' HD23 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -66.95 -5.39 12.5 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.625 -179.845 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.605 HD23 ' HD3' ' A' ' 83' ' ' LYS . 3.0 mt -95.16 -10.28 30.99 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.925 0.393 . . . . 0.0 110.2 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -119.96 116.31 25.53 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.495 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -71.89 -27.82 63.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.94 0.4 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.46 171.52 17.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.909 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 93' ' ' LEU . 62.2 t -81.17 132.27 56.86 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.561 0.22 . . . . 0.0 110.899 179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.428 ' HD2' ' HB2' ' A' ' 93' ' ' LEU . 93.4 Cg_exo -45.1 164.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.687 2.258 . . . . 0.0 112.656 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -51.98 -35.61 61.51 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.643 2.229 . . . . 0.0 112.596 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -93.12 -36.79 12.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.42 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.405 ' O ' ' HD2' ' A' ' 116' ' ' PRO . . . 157.37 175.38 28.23 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.469 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.829 ' HB2' HG13 ' A' ' 88' ' ' VAL . 3.2 tm? -122.15 120.24 33.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.39 . . . . 0.0 110.807 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 38' ' ' ILE . 91.2 t -134.83 111.85 14.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.609 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 112' ' ' ILE . 41.5 t -117.72 149.77 19.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.513 ' CD1' ' HA ' ' A' ' 36' ' ' SER . 22.2 m-30 -130.42 130.57 44.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.903 0.382 . . . . 0.0 111.168 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 110' ' ' VAL . 68.9 m -142.16 130.97 22.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -168.35 168.5 40.96 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.399 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.5 m -107.65 127.29 53.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.633 0.254 . . . . 0.0 110.74 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.922 HG21 ' HB1' ' A' ' 27' ' ' ALA . 1.1 pt -116.96 155.37 18.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 111.448 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 17.6 t -116.9 143.65 26.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.7 p -104.52 160.95 14.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.551 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -53.81 -30.26 44.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.943 0.402 . . . . 0.0 110.545 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.33 -14.48 62.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.427 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 94.43 -5.26 70.6 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.836 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.6 mmtt -81.89 134.26 35.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.901 0.381 . . . . 0.0 110.824 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -76.78 148.95 36.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.104 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.1 154.12 50.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.472 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 130.08 51.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.381 . . . . 0.0 110.895 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 97' ' ' CYS . 27.7 t -113.02 107.05 22.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.045 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -117.23 110.54 18.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.414 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.646 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.9 mt -130.28 141.31 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.636 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -134.61 131.64 38.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.248 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.626 ' HZ ' HD11 ' A' ' 136' ' ' LEU . 11.5 p90 -169.87 170.25 7.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.013 0.435 . . . . 0.0 111.592 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.424 ' HB3' ' CB ' ' A' ' 89' ' ' PRO . 10.3 pt-20 -93.46 145.5 30.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.45 ' HD3' HG23 ' A' ' 94' ' ' VAL . 23.9 Cg_endo -61.64 168.01 9.07 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.304 2.002 . . . . 0.0 112.389 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.922 ' CZ ' HD12 ' A' ' 14' ' ' ILE . 5.5 t80 -61.39 -36.42 80.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.961 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.423 ' HB3' ' HD2' ' A' ' 119' ' ' PRO . 0.1 OUTLIER -145.08 167.47 14.52 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.539 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.534 ' O ' HD13 ' A' ' 120' ' ' ILE . 39.2 Cg_exo -57.61 132.87 52.95 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.323 2.016 . . . . 0.0 112.328 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 119' ' ' PRO . 29.7 mm -128.26 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.204 179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.9 m120 -90.29 44.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.587 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 25.3 m -155.22 112.14 3.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.711 0.291 . . . . 0.0 111.202 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 38' ' ' ILE . 14.2 p -77.77 111.08 13.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.836 0.35 . . . . 0.0 110.976 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.545 ' C ' HD23 ' A' ' 124' ' ' LEU . 8.6 tt -108.55 133.39 52.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.115 0.483 . . . . 0.0 111.879 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.727 ' HE1' HG23 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -130.6 113.13 13.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.855 179.235 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.809 HD22 ' CD2' ' A' ' 132' ' ' HIS . 0.2 OUTLIER -136.72 129.04 29.96 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 34' ' ' MET . 53.7 t -120.94 129.5 53.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.955 179.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' A' ' 32' ' ' THR . 5.2 t0 -160.59 -158.05 0.58 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.637 0.256 . . . . 0.0 110.868 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASN . . . . . 0.595 ' CG ' HG22 ' A' ' 32' ' ' THR . 6.3 m-80 -82.1 6.17 17.2 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.617 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.09 158.49 12.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.8 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PHE . . . . . 0.529 ' CD2' HD22 ' A' ' 24' ' ' LEU . 81.0 m-85 -73.94 126.31 30.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.809 ' CD2' HD22 ' A' ' 126' ' ' LEU . 94.4 m-70 -93.81 95.75 9.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.087 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . 1.052 HG22 HD12 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -86.3 54.88 3.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.919 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.66 ' O ' ' HB2' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -68.53 -47.92 65.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.783 179.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.35 64.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.168 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.052 HD12 HG22 ' A' ' 133' ' ' THR . 24.9 mt -79.75 -49.12 12.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.024 0.44 . . . . 0.0 110.841 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.6 m -80.46 -5.83 57.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.107 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 134' ' ' GLU . . . -68.74 -33.63 74.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.09 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.532 HD22 ' O ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -62.93 -56.33 18.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 179.929 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.569 HD21 HD11 ' A' ' 14' ' ' ILE . 4.5 mm? -64.22 -40.59 96.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.8 t -70.57 -31.0 67.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.938 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.934 179.919 . . . . . . . . 0 0 . 1 stop_ save_